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Doxepine-d3 Hydrochloride

CAT: 1459-CS-O-06564Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-06564Size:1 Each
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Description
Doxepine-d3 Hydrochloride is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Doxepin. The product is supplied by Clearsynth under CAT No. CS-O-06564. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
347840-07-7
Synonyms
Doxepine-d3 Hydrochloride
Molecular Formula
C 19 H 19 D 3 ClNO
Molecular Weight
318.86
Additionnal Information
Doxepine-d3 Hydrochloride is supplied with detailed characterization data compliant with regulatory guideline. Doxepine-d3 Hydrochloride can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Doxepin.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Doxepin-d3 Hydrochloride
CAS Number347840-07-7
PubChem CID71433754
IUPAC Name3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methyl-N-(trideuteriomethyl)propan-1-amine;hydrochloride
Molecular FormulaC19H22ClNO
Molecular Weight318.9
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity363
SMILES
[2H]C([2H])([2H])N(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl
InChI
InChI=1S/C19H21NO.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H/i1D3;
InChIKey
MHNSPTUQQIYJOT-NIIDSAIPSA-N
Chemical Structure
2D Structure
2D structure of Doxepin-d3 Hydrochloride
CAS: 347840-07-7
CID: 71433754
Formula: C19H22ClNO
MW: 318.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass318.1578223
Monoisotopic Mass318.1578223
Topological Polar Surface Area12.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity363
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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