Chemical Properties of Retronecine (CAS 480-85-3)

Retronecine

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InChI
InChI=1S/C8H13NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,7-8,10-11H,2-5H2/t7-,8?/m0/s1
InChI Key
HJSJELVDQOXCHO-JAMMHHFISA-N
Formula
C8H13NO2
SMILES
OCC1=CCN2CCC(O)C12
Molecular Weight1
155.19
CAS
480-85-3
Other Names
  • Relronecine (7R)
  • Retronecine (7R)
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Physical Properties

Property Value Unit Source
log10WS -0.14 Crippen Calculated Property
logPoct/wat -0.646 Crippen Calculated Property
McVol 119.280 ml/mol McGowan Calculated Property
Inp [1425.00; 1465.00]   Show Hide
Inp 1430.00 NIST
Inp 1425.00 NIST
Inp Outlier 1465.00 NIST
Inp 1428.00 NIST
Inp 1428.00 NIST
Inp 1425.00 NIST

Similar Compounds

1H-Pyrrolizine-7-methanol, 2,3,5,7a-tetrahydro-1-hydroxy-, (1S-cis)-. 9-Senicioylheliotridine. 9-tigloylretronecine. 9-Angeloylretronecine. 9-Senecioylretronecine. 9-tigloylheliotridine. 9-Isosenecioylretronecine. 5,6-Dihydro-7,9-dimethoxy-7H-pyrrolizine. 9-Hydroxyisohexenoylretronecine. 7-tigloylheliotridine. 2-Butenoic acid, 2-methyl-, 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl ester, [1S-[1«alpha»(Z),7a«alpha»]]-. 7-tigloylretronecine. [(7R)-7-Hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl hexanoate. 9-Hydroxyheptanoylretronecine. 7-acetylretronecine.

Find more compounds similar to Retronecine.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.