Chemical Properties of Phenazocine (CAS 127-35-5)

InChI

InChI=1S/C22H27NO/c1-16-21-14-18-8-9-19(24)15-20(18)22(16,2)11-13-23(21)12-10-17-6-4-3-5-7-17/h3-9,15-16,21,24H,10-14H2,1-2H3

InChI Key

ZQHYKVKNPWDQSL-UHFFFAOYSA-N

Formula

C22H27NO

SMILES

CC1C2Cc3ccc(O)cc3C1(C)CCN2CCc1ccccc1

Molecular Weight¹

321.46

CAS

127-35-5

Other Names

• 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(2-phenylethyl)-
• 2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-phenethyl-
• NIH 7519
• Prinadol
• SKF 6574
• 6,11-Dimethyl-1,2,3,4,5,6-hexahydro-8-hydroxy-3-phenethyl-2,6-methano-3-benzazocine
• 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-phenethyl-2,6-methano-3-benzazocin-8-ol
• 1,2,3,4,5,6-Hexahydro-8-hydroxy-6,11-dimethyl-3-phenethyl-2,6-methano-3-benzazocine
• 2'-Hydroxy-5,9-dimethyl-2-phenethyl-6,7-benzomorphan
• 1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(2-phenylethyl)-2,6-methano-3-benzazocin-8-ol
• Phenethylazocine
• Phenobenzorphan

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-4.65		Crippen Calculated Property
logPoct/wat	4.159		Crippen Calculated Property
McVol	267.450	ml/mol	McGowan Calculated Property
Inp	[2677.00; 2720.00]
Inp	2677.00		NIST
Inp	2720.00		NIST
Inp	2684.00		NIST
Inp	2677.00		NIST

Similar Compounds

Find more compounds similar to Phenazocine.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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