CAS
934110-16-4 Purity
96%
934110-16-4 Purity
96%
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s-Venlafaxine
CAS
93413-44-6
Catalog Number
ACM93413446
Category
Other Products
Molecular Weight
277.4
Molecular Formula
C17H27NO2
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Specification
Synonyms
S-VENLAFAXINE
IUPAC Name
1-[(1S)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
Canonical SMILES
CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O
InChI Key
PNVNVHUZROJLTJ-MRXNPFEDSA-N
Boiling Point
397.575ºC at 760 mmHg
Melting Point
102-104ºC
Flash Point
194.246ºC
Density
1.06g/cm³
Appearance
White Solid
Exact Mass
277.20400
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of s-Venlafaxine?
The molecular formula of s-Venlafaxine is C17H27NO2.
What is the molecular weight of s-Venlafaxine?
The molecular weight of s-Venlafaxine is 277.4 g/mol.
What are some synonyms for s-Venlafaxine?
Some synonyms for s-Venlafaxine include (S)-VENLAFAXINE, S-Venlafaxine, and Venlafaxine, (S)-.
What is the IUPAC name of s-Venlafaxine?
The IUPAC name of s-Venlafaxine is 1-[(1S)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol.
What is the InChIKey of s-Venlafaxine?
The InChIKey of s-Venlafaxine is PNVNVHUZROJLTJ-MRXNPFEDSA-N.
What is the Canonical SMILES of s-Venlafaxine?
The Canonical SMILES of s-Venlafaxine is CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O.
What is the XLogP3-AA value of s-Venlafaxine?
The XLogP3-AA value of s-Venlafaxine is 2.9.
How many hydrogen bond donor counts does s-Venlafaxine have?
s-Venlafaxine has 1 hydrogen bond donor count.
What is the exact mass of s-Venlafaxine?
The exact mass of s-Venlafaxine is 277.204179104 g/mol.
How many rotatable bond counts does s-Venlafaxine have?
s-Venlafaxine has 5 rotatable bond counts.
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