Chemical Properties of 1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, [1aR-(1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»)]- (CAS 17334-55-3)

1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, [1aR-(1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»)]-

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InChI
InChI=1S/C15H24/c1-10-6-5-7-11-8-9-12-13(14(12,2)3)15(10,11)4/h7,10,12-13H,5-6,8-9H2,1-4H3/t10-,12?,13?,15+/m1/s1
InChI Key
MBIPADCEHSKJDQ-ADBWKJQBSA-N
Formula
C15H24
SMILES
CC1CCC=C2CCC3C(C3(C)C)C21C
Molecular Weight1
204.35
CAS
17334-55-3
Other Names
  • 1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aR,7R,7aR,7bS)-(+)-
  • (1aR,7R,7aR,7bS)-1,1,7,7a-Tetramethyl-1a,2,3,5,6,7,7a,7b-octahydro-1H-cyclopropa[a]naphthalene
  • «beta»-Gurjunene
  • «delta»1(10)-Aristolene
  • Calarene
  • 1(10)-Aristolene, (+)-
  • (+)-Calarene
  • «delta»-Aristol-1(10)-ene
  • (+)-1(10)-Aristolene
  • (+)-«delta»1(10)-Aristolene
  • 1(10)-Aristolene
  • «beta»-Gurjenene
  • Calarene (= «beta»-gurjunene)
  • «beta»-Gurjurene
  • Calarene («beta»-gurjunene)
  • «beta»-Gurjunene (calarene)
  • [1aR-(1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»)]-1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-1H-cyclopropa[a]naphthalene

Physical Properties

Property Value Unit Source
Δf 227.40 kJ/mol Joback Calculated Property
Δfgas -110.74 kJ/mol Joback Calculated Property
Δfus 15.19 kJ/mol Joback Calculated Property
Δvap 47.10 kJ/mol Joback Calculated Property
log10WS -4.43 Crippen Calculated Property
logPoct/wat 4.415 Crippen Calculated Property
McVol 185.330 ml/mol McGowan Calculated Property
Pc 2117.78 kPa Joback Calculated Property
Inp [1387.00; 1482.00]   Show Hide
Inp 1435.00 NIST
Inp 1442.00 NIST
Inp 1432.00 NIST
Inp 1426.00 NIST
Inp 1442.00 NIST
Inp 1440.00 NIST
Inp 1409.00 NIST
Inp 1443.00 NIST
Inp 1433.00 NIST
Inp 1432.00 NIST
Inp 1428.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1431.00 NIST
Inp 1436.00 NIST
Inp 1423.00 NIST
Inp 1430.00 NIST
Inp 1409.00 NIST
Inp 1429.00 NIST
Inp 1406.00 NIST
Inp 1435.00 NIST
Inp 1432.00 NIST
Inp Outlier 1463.00 NIST
Inp 1437.00 NIST
Inp Outlier 1470.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1428.00 NIST
Inp 1432.00 NIST
Inp 1409.00 NIST
Inp 1434.00 NIST
Inp 1434.00 NIST
Inp 1426.00 NIST
Inp 1428.00 NIST
Inp 1432.00 NIST
Inp 1431.00 NIST
Inp 1427.00 NIST
Inp 1431.00 NIST
Inp 1432.00 NIST
Inp Outlier 1398.00 NIST
Inp 1422.00 NIST
Inp 1440.00 NIST
Inp 1425.00 NIST
Inp 1418.00 NIST
Inp 1421.00 NIST
Inp 1430.00 NIST
Inp 1424.00 NIST
Inp 1434.00 NIST
Inp 1422.00 NIST
Inp 1433.00 NIST
Inp 1423.00 NIST
Inp 1409.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp 1437.00 NIST
Inp 1435.00 NIST
Inp 1433.00 NIST
Inp 1426.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp 1432.00 NIST
Inp 1430.00 NIST
Inp 1429.00 NIST
Inp 1439.00 NIST
Inp 1458.00 NIST
Inp 1440.00 NIST
Inp 1430.00 NIST
Inp 1407.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1410.00 NIST
Inp 1409.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp 1432.00 NIST
Inp 1428.00 NIST
Inp 1427.00 NIST
Inp 1432.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1425.00 NIST
Inp 1442.00 NIST
Inp 1427.00 NIST
Inp 1427.00 NIST
Inp Outlier 1398.00 NIST
Inp 1423.00 NIST
Inp 1419.00 NIST
Inp 1431.00 NIST
Inp 1428.00 NIST
Inp 1449.00 NIST
Inp 1427.00 NIST
Inp 1430.00 NIST
Inp Outlier 1402.00 NIST
Inp 1435.00 NIST
Inp 1413.00 NIST
Inp 1457.00 NIST
Inp 1429.00 NIST
Inp 1427.00 NIST
Inp 1433.00 NIST
Inp 1446.00 NIST
Inp Outlier 1461.00 NIST
Inp 1435.00 NIST
Inp 1434.00 NIST
Inp 1430.00 NIST
Inp 1426.00 NIST
Inp 1416.00 NIST
Inp 1423.00 NIST
Inp 1449.00 NIST
Inp 1432.00 NIST
Inp Outlier 1465.00 NIST
Inp Outlier 1467.00 NIST
Inp 1434.00 NIST
Inp 1427.00 NIST
Inp 1436.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1440.00 NIST
Inp 1443.00 NIST
Inp 1432.00 NIST
Inp 1431.00 NIST
Inp 1436.00 NIST
Inp 1429.00 NIST
Inp 1422.00 NIST
Inp 1430.00 NIST
Inp 1434.00 NIST
Inp 1435.00 NIST
Inp 1423.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp 1421.00 NIST
Inp 1450.00 NIST
Inp 1431.00 NIST
Inp 1442.00 NIST
Inp 1442.00 NIST
Inp 1432.00 NIST
Inp 1428.00 NIST
Inp 1430.00 NIST
Inp 1429.00 NIST
Inp Outlier 1475.00 NIST
Inp 1433.00 NIST
Inp Outlier 1387.00 NIST
Inp 1434.00 NIST
Inp 1415.00 NIST
Inp 1430.00 NIST
Inp 1427.00 NIST
Inp 1438.00 NIST
Inp 1429.00 NIST
Inp 1429.00 NIST
Inp 1434.00 NIST
Inp 1429.00 NIST
Inp 1435.00 NIST
Inp 1432.00 NIST
Inp 1435.00 NIST
Inp 1432.00 NIST
Inp 1430.00 NIST
Inp 1434.00 NIST
Inp 1443.00 NIST
Inp 1438.00 NIST
Inp 1429.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp Outlier 1398.00 NIST
Inp 1433.00 NIST
Inp 1420.00 NIST
Inp 1452.00 NIST
Inp 1439.00 NIST
Inp 1450.00 NIST
Inp 1424.00 NIST
Inp 1424.00 NIST
Inp Outlier 1478.00 NIST
Inp Outlier 1403.00 NIST
Inp 1434.00 NIST
Inp 1436.00 NIST
Inp 1426.00 NIST
Inp Outlier 1464.00 NIST
Inp 1428.00 NIST
Inp 1428.00 NIST
Inp 1428.00 NIST
Inp 1427.00 NIST
Inp 1435.00 NIST
Inp 1434.00 NIST
Inp Outlier 1395.00 NIST
Inp 1424.00 NIST
Inp 1425.00 NIST
Inp Outlier 1482.00 NIST
Inp 1430.00 NIST
Inp 1426.00 NIST
Inp 1430.00 NIST
Inp 1430.00 NIST
Inp 1432.00 NIST
Inp 1430.00 NIST
Inp 1450.00 NIST
Inp 1430.00 NIST
Inp 1442.00 NIST
Inp 1432.00 NIST
Inp 1429.00 NIST
Inp 1434.00 NIST
Inp 1426.00 NIST
Inp 1432.00 NIST
Inp 1422.00 NIST
Inp 1430.00 NIST
Inp 1432.00 NIST
Inp 1409.00 NIST
Inp 1423.00 NIST
Inp 1432.00 NIST
Inp 1429.00 NIST
Inp 1414.00 NIST
Inp 1425.00 NIST
Inp 1425.00 NIST
Inp 1430.00 NIST
Inp 1434.00 NIST
Inp 1434.00 NIST
Inp 1433.00 NIST
Inp 1433.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1444.00 NIST
Inp 1434.00 NIST
Inp 1429.00 NIST
Inp 1433.00 NIST
Inp 1417.00 NIST
Inp 1437.00 NIST
Inp 1432.00 NIST
Inp 1430.00 NIST
Inp 1429.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp Outlier 1388.00 NIST
Inp Outlier 1471.00 NIST
Inp 1425.50 NIST
Inp Outlier 1480.00 NIST
Inp 1434.00 NIST
Inp 1429.00 NIST
Inp 1430.00 NIST
Inp 1434.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1427.00 NIST
Inp 1431.00 NIST
Inp 1431.00 NIST
Inp 1429.00 NIST
Inp 1430.00 NIST
Inp 1441.00 NIST
Inp Outlier 1474.00 NIST
Inp 1428.00 NIST
Inp 1427.70 NIST
Inp 1442.00 NIST
Inp 1435.00 NIST
Inp Outlier 1467.00 NIST
Inp Outlier 1467.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1436.00 NIST
Inp 1432.00 NIST
Inp 1433.00 NIST
Inp 1433.00 NIST
Inp 1432.00 NIST
Inp 1434.00 NIST
Inp 1412.00 NIST
Inp 1427.00 NIST
Inp Outlier 1460.00 NIST
Inp 1432.00 NIST
Inp 1426.00 NIST
Inp 1458.00 NIST
Inp 1432.00 NIST
Inp 1429.00 NIST
Inp 1434.00 NIST
Inp 1430.00 NIST
Inp 1428.00 NIST
Inp 1434.00 NIST
Inp 1426.00 NIST
Inp 1429.00 NIST
Inp 1432.00 NIST
Inp 1427.00 NIST
Inp 1423.00 NIST
Inp Outlier 1467.00 NIST
Inp 1434.00 NIST
Inp 1420.00 NIST
Inp 1434.00 NIST
Inp 1432.00 NIST
Inp 1429.00 NIST
Inp 1428.00 NIST
Inp 1428.00 NIST
Inp 1432.00 NIST
Inp Outlier 1463.00 NIST
Inp 1432.00 NIST
Inp 1427.00 NIST
Inp 1432.00 NIST
Inp 1430.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1425.00 NIST
Inp 1446.00 NIST
Inp 1427.00 NIST
Inp 1432.00 NIST
Inp 1417.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp 1432.00 NIST
Inp Outlier 1387.00 NIST
Inp Outlier 1388.00 NIST
Inp 1428.00 NIST
Inp Outlier 1460.00 NIST
Inp Outlier 1475.00 NIST
Inp 1439.00 NIST
Inp 1426.00 NIST
Inp 1425.00 NIST
Inp 1432.00 NIST
Inp 1435.00 NIST
Inp 1433.00 NIST
Inp 1430.00 NIST
Inp 1442.00 NIST
Inp 1409.00 NIST
Inp 1434.00 NIST
Inp 1436.00 NIST
Inp 1426.00 NIST
Inp 1432.00 NIST
Inp 1420.00 NIST
Inp 1428.00 NIST
Inp Outlier 1475.00 NIST
I [1559.00; 1656.00]   Show Hide
I 1618.00 NIST
I Outlier 1656.00 NIST
I 1590.00 NIST
I 1591.00 NIST
I 1577.00 NIST
I 1586.00 NIST
I 1564.00 NIST
I Outlier 1655.00 NIST
I 1564.00 NIST
I 1580.00 NIST
I 1564.00 NIST
I 1652.00 NIST
I 1604.00 NIST
I 1559.00 NIST
I 1622.00 NIST
I 1601.00 NIST
I 1652.00 NIST
I 1567.00 NIST
I 1596.00 NIST
I 1600.00 NIST
I 1606.00 NIST
I 1617.00 NIST
I 1606.00 NIST
I 1617.00 NIST
I 1606.00 NIST
I 1606.00 NIST
I 1606.00 NIST
I 1606.00 NIST
I 1606.00 NIST
I 1606.00 NIST
I 1583.00 NIST
I 1616.00 NIST
I 1593.00 NIST
I 1593.00 NIST
I 1599.00 NIST
I 1612.00 NIST
I 1567.00 NIST
I 1610.00 NIST
I 1600.00 NIST
I 1610.00 NIST
I 1595.00 NIST
I 1592.00 NIST
I Outlier 1655.00 NIST
I 1610.00 NIST
I 1610.00 NIST
I 1610.00 NIST
I 1590.00 NIST
I Outlier 1655.00 NIST
I 1618.00 NIST
Tboil 566.64 K Joback Calculated Property
Tc 792.17 K Joback Calculated Property
Tfus 358.19 K Joback Calculated Property
Vc 0.711 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [503.55; 623.74] J/mol×K [566.64; 792.17] Show Hide
Cp,gas 503.55 J/mol×K 566.64 Joback Calculated Property
Cp,gas 526.55 J/mol×K 604.23 Joback Calculated Property
Cp,gas 547.97 J/mol×K 641.82 Joback Calculated Property
Cp,gas 568.10 J/mol×K 679.41 Joback Calculated Property
Cp,gas 587.25 J/mol×K 716.99 Joback Calculated Property
Cp,gas 605.70 J/mol×K 754.58 Joback Calculated Property
Cp,gas 623.74 J/mol×K 792.17 Joback Calculated Property

Similar Compounds

1H-Cycloprop[a]naphthalene, 1a,2,3,5,6,7a,7b-octahydro-1,1,7,7a-tetramethyl, [1aR,1a«alpha»,7«alpha»,7b«beta»]. [1aR-(1a,R,7R,7aR,7bR)]-1a,2,3,5,6,7,7a,7bocta-hydro-1,1,7,7a-tetramethyl-1H-cyclopropa[a]naphthalene. 1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7a,7b-octahydro-1,1,7,7a-tetramethyl-, 1aR-1a«alpha»,7«alpha»,7a«alpha»,7b«beta». «beta»-Calarene. 1(10)-Aristolene. 1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»-1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl. (-)-Aristolene. «alpha»-Maaliene. Cholest-4-ene. Tricyclo[6.3.0.0(2,4)]undec-8-ene, 3,3,7,11-tetramethyl-. 1,1,4,7-Tetramethyl-1a,2,3,4,6,7,7a,7b-octahydro-1H-cyclopropa[e]azulene. Aristolochene. anastreptene. cyclocopacamphene. Cholest-5-ene.

Find more compounds similar to 1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, [1aR-(1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»)]-.

Sources

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