Tenofovir Impurity 264

CAT: 1299-RM-T140864-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-T140864-01Size:10 mg

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CAS Number

49622-08-4

Synonyms

Chloromethyl dimethylcarbamate

Molecular Formula

C4H8ClNO2

Molecular Weight

137.56

Target Alternative Name

Tenofovir

Product Name Synonym

Chloromethyl dimethylcarbamate

Chemical Information

chloromethyl N,N-dimethylcarbamate

CAS Number	49622-08-4
PubChem CID	15759424
IUPAC Name	chloromethyl N,N-dimethylcarbamate
Molecular Formula	C4H8ClNO2
Molecular Weight	137.56
XLogP	1.2
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	8
Formal Charge	0
Complexity	84

SMILES

CN(C)C(=O)OCCl

InChI

InChI=1S/C4H8ClNO2/c1-6(2)4(7)8-3-5/h3H2,1-2H3

InChIKey

ODDBDWWPSOCNIB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 49622-08-4

CID: 15759424

Formula: C4H8ClNO2

MW: 137.56

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.56
XLogP3	1.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	137.0243562
Monoisotopic Mass	137.0243562
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	84.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes