Zidovudine Impurity C

CAT: 1299-RM-Z042203-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-Z042203-01Size:10 mg

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CAS Number

32189-36-9

Synonyms

(R) -2- (4-chlorophenyl) -2-hydroxyacetic acid

Molecular Formula

C8H7ClO3

Molecular Weight

186.59

Target Alternative Name

Zidovudine

Product Name Synonym

(R) -2- (4-chlorophenyl) -2-hydroxyacetic acid

Chemical Information

(R)-4-Chloromandelic acid

CAS Number	32189-36-9
PubChem CID	785085
IUPAC Name	(2R)-2-(4-chlorophenyl)-2-hydroxyacetic acid
Molecular Formula	C8H7ClO3
Molecular Weight	186.59
XLogP	1.2
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	164

SMILES

C1=CC(=CC=C1[C@H](C(=O)O)O)Cl

InChI

InChI=1S/C8H7ClO3/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)/t7-/m1/s1

InChIKey

BWSFWXSSALIZAU-SSDOTTSWSA-N

Chemical Structure

2D Structure

CAS: 32189-36-9

CID: 785085

Formula: C8H7ClO3

MW: 186.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	186.59
XLogP3	1.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	186.0083718
Monoisotopic Mass	186.0083718
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	164
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes