Chemical Properties of Methyl abietate (CAS 127-25-3)

Methyl abietate

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InChI
InChI=1S/C21H32O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h8,13-14,17-18H,6-7,9-12H2,1-5H3/t17?,18?,20?,21-/m0/s1
InChI Key
OVXRPXGVKBHGQO-QDDLRWIDSA-N
Formula
C21H32O2
SMILES
COC(=O)C1(C)CCCC2(C)C3CCC(C(C)C)=CC3=CCC12
Molecular Weight1
316.48
CAS
127-25-3
Other Names
  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-
  • Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, methyl ester
  • Abietic acid, methyl ester
  • Methyl 7,13-abietadien-18-oate
  • Wood rosin, methyl ester
  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, (1R,4aR,4bR,10aR)-
  • NSC 2141

Physical Properties

Property Value Unit Source
Δf 33.30 kJ/mol Joback Calculated Property
Δfgas -436.49 kJ/mol Joback Calculated Property
Δfus 23.46 kJ/mol Joback Calculated Property
Δvap 71.00 kJ/mol Joback Calculated Property
log10WS -5.66 Crippen Calculated Property
logPoct/wat 5.295 Crippen Calculated Property
McVol 273.010 ml/mol McGowan Calculated Property
Pc 1518.75 kPa Joback Calculated Property
Inp [2339.00; 2393.00]   Show Hide
Inp 2344.00 NIST
Inp 2356.00 NIST
Inp 2380.00 NIST
Inp 2339.00 NIST
Inp 2377.00 NIST
Inp 2393.00 NIST
Inp 2380.00 NIST
Inp 2380.00 NIST
I [3016.00; 3016.00]   Show Hide
I 3016.00 NIST
I 3016.00 NIST
I 3016.00 NIST
Tboil 801.39 K Joback Calculated Property
Tc 1033.26 K Joback Calculated Property
Tfus 489.93 K Joback Calculated Property
Vc 1.028 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [886.67; 1033.50] J/mol×K [801.39; 1033.26] Show Hide
Cp,gas 886.67 J/mol×K 801.39 Joback Calculated Property
Cp,gas 911.14 J/mol×K 840.03 Joback Calculated Property
Cp,gas 935.22 J/mol×K 878.68 Joback Calculated Property
Cp,gas 959.20 J/mol×K 917.32 Joback Calculated Property
Cp,gas 983.38 J/mol×K 955.97 Joback Calculated Property
Cp,gas 1008.04 J/mol×K 994.61 Joback Calculated Property
Cp,gas 1033.50 J/mol×K 1033.26 Joback Calculated Property

Similar Compounds

Methyl abieta-7,13-dien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,9,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl 8(14),12-Abietadien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Abietic acid. Methyl 8(14),13(15)-Abietadien-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. Methyl 13«beta»-Abieta-7,9(11)dien-18-oate. Methyl palustrate. Methyl 8,13-Abietadien-18-oate. Abietic acid, trimethylsilyl ester. 1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-2,4-pentadienyl)-, methyl ester, [1S-[1«alpha»,4a«alpha»,5«alpha»(E),8a«beta»]]-. ((1S,4aR,4bR,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthren-1-yl)methyl acetate. Methyl abiet-7-en-18-oate. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-.

Find more compounds similar to Methyl abietate.

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