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1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol

1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol structure

CAS No:
149289-29-2
Formula:
C14H21NO2
Chemical Name:
1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol
Synonyms:
O-Desmethyl-N,N-didesmethylvenlafaxine;Tridesmethylvenlafaxine;D,L-N,N-DidesMethyl-O-desMethyl Venlafaxine;4-[2-amino-1-(1-hydroxycyclohexyl)ethyl]phenol;Desvenlafaxine N,N-Didesmethyl Imp

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1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol Basic Attributes

Molecular Weight：

235.32204

Exact Mass：

235.157

EC Number：

1533716-785-6

Characteristics

PSA：

66.5

XLogP3：

2.2

Density：

1.179

Boiling Point：

405.0±20.0 °C(Predicted)

Drug Information

Metabolism/Metabolites：

O-Desmethylvenlafaxine has known human metabolites that include (2S,3S,4S,5R,6S)-6-[4-[2-Amino-1-(1-hydroxycyclohexyl)ethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.

Computed Properties

Molecular Weight:235.32
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:235.157228913
Monoisotopic Mass:235.157228913
Topological Polar Surface Area:66.5
Heavy Atom Count:17
Complexity:230
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sodium aluminum sulfate; butan-2-ol; 1-bromopropane; adenosine price; sodium diacetate; chemiewerk

Guide of 1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol

Basic Attributes
Characteristics
Drug Information
Computed Properties

1-[2-amino-1-(4-hydroxyphenyl)ethyl]cyclohexanol

SDS

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