Products for Research Use Only
RegisterLogin

Dehydro Venlafaxine

CAT: 0572-TRC-D230580-10MGSize: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-D230580-10MGSize:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
93413-57-1
Synonyms
Benzeneethanamine, β-1-cyclohexen-1-yl-4-methoxy-N,N-dimethyl-; Benzeneethanamine, β-1-cyclohexen-1-yl-4-methoxy-N,N-dimethyl-, (±)-; β-1-Cyclohexen-1-yl-4-methoxy-N,N-dimethylbenzeneethanamine; (2RS)-2-(Cyclohex-1-enyl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine; Dehydrovenlafaxine
Hazard Statement
Causes serious eye irritation.
Smiles
COc1ccc(cc1)C(CN(C)C)C2=CCCCC2
Molecular Formula
C17 H25 N O
Molecular Weight
259.39
InChI
InChI=1S/C17H25NO/c1-18(2)13-17(14-7-5-4-6-8-14)15-9-11-16(19-3)12-10-15/h7,9-12,17H,4-6,8,13H2,1-3H3
Additionnal Information
IUPAC name: 2-(cyclohexen-1-yl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-(Cyclohex-1-enyl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
CAS Number93413-57-1
PubChem CID13520348
IUPAC Name2-(cyclohexen-1-yl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
Molecular FormulaC17H25NO
Molecular Weight259.4
XLogP3.7
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity290
SMILES
CN(C)CC(C1=CCCCC1)C2=CC=C(C=C2)OC
InChI
InChI=1S/C17H25NO/c1-18(2)13-17(14-7-5-4-6-8-14)15-9-11-16(19-3)12-10-15/h7,9-12,17H,4-6,8,13H2,1-3H3
InChIKey
OARSYJZOOXFPDU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Cyclohex-1-enyl)-2-(4-methoxyphenyl)-N,N-dimethylethanamine
CAS: 93413-57-1
CID: 13520348
Formula: C17H25NO
MW: 259.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight259.4
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass259.193614421
Monoisotopic Mass259.193614421
Topological Polar Surface Area12.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity290
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-D230605-10MGrac Dehydro-O-desmethyl Venlafaxine
TRC-D230605-1MGrac Dehydro-O-desmethyl Venlafaxine
TRC-D288300-100MGDeoxy Venlafaxine
TRC-V120008-50MGS-Venlafaxine
TRC-V120003-10MGR-Venlafaxine
TRC-V120008-5MGS-Venlafaxine
TRC-D288300-50MGDeoxy Venlafaxine
TRC-V120003-50MGR-Venlafaxine
TRC-V120008-10MGS-Venlafaxine
TRC-D288300-10MGDeoxy Venlafaxine

Alternative Products

CatalogName
MBS6029022-01Dehydro Venlafaxine
HY-131284(S) -Dehydro Venlafaxine
MBS5816012(S)-Dehydro Venlafaxine
CS-T-51820Rac Dehydro-O-desmethyl Venlafaxine
CS-T-73341Rac Dehydro-O-desmethyl Venlafaxine-d6
MBS340900-01Venlafaxine

Popular Products