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Linezolid Impurity 32

CAT: 1299-RM-L142632-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-L142632-01Size:10 mg
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CAS Number
589489-13-4
Synonyms
(2S,2'S) - (acetylazanediyl) bis (1-chloropropane-3,2-diyl) diacetate
Molecular Formula
C12H19Cl2NO5
Molecular Weight
328.19
Target Alternative Name
Linezolid
Product Name Synonym
(2S,2'S) - (acetylazanediyl) bis (1-chloropropane-3,2-diyl) diacetate

Chemical Information

Linezolid Impurity 32
CAS Number589489-13-4
PubChem CID177831454
IUPAC Name[(2S)-1-[acetyl-(2-acetyloxy-3-chloropropyl)amino]-3-chloropropan-2-yl] acetate
Molecular FormulaC12H19Cl2NO5
Molecular Weight328.19
XLogP0.8
Topological Polar Surface Area72.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count20
Formal Charge0
Complexity325
SMILES
CC(=O)N(C[C@@H](CCl)OC(=O)C)CC(CCl)OC(=O)C
InChI
InChI=1S/C12H19Cl2NO5/c1-8(16)15(6-11(4-13)19-9(2)17)7-12(5-14)20-10(3)18/h11-12H,4-7H2,1-3H3/t11-,12?/m1/s1
InChIKey
VKTZVUWMJUXHSM-JHJMLUEUSA-N
Chemical Structure
2D Structure
2D structure of Linezolid Impurity 32
CAS: 589489-13-4
CID: 177831454
Formula: C12H19Cl2NO5
MW: 328.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight328.19
XLogP30.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass327.0640281
Monoisotopic Mass327.0640281
Topological Polar Surface Area72.9 Ų
Heavy Atom Count20
Formal Charge0
Complexity325
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes