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Clopidogrel Impurity 64

CAT: 1299-RM-C160794-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-C160794-02Size:25 mg
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CAS Number
141109-16-2
Synonyms
Methyl (R) -2-amino-2- (2-chlorophenyl) acetate
Molecular Formula
C9H10ClNO2
Molecular Weight
199.63
Target Alternative Name
Clopidogrel
Product Name Synonym
Methyl (R) -2-amino-2- (2-chlorophenyl) acetate

Chemical Information

methyl (2R)-2-amino-2-(2-chlorophenyl)acetate
CAS Number141109-16-2
PubChem CID11735787
IUPAC Namemethyl (2R)-2-amino-2-(2-chlorophenyl)acetate
Molecular FormulaC9H10ClNO2
Molecular Weight199.63
XLogP1.5
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity186
SMILES
COC(=O)[C@@H](C1=CC=CC=C1Cl)N
InChI
InChI=1S/C9H10ClNO2/c1-13-9(12)8(11)6-4-2-3-5-7(6)10/h2-5,8H,11H2,1H3/t8-/m1/s1
InChIKey
UTWOZNRDJNWTPS-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of methyl (2R)-2-amino-2-(2-chlorophenyl)acetate
CAS: 141109-16-2
CID: 11735787
Formula: C9H10ClNO2
MW: 199.63
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight199.63
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass199.0400063
Monoisotopic Mass199.0400063
Topological Polar Surface Area52.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity186
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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