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(S) -2- (2-Chlorophenyl) oxirane

CAT: 0024-sc-501129Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-501129Size:100 mg
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CAS Number
141394-10-7

Chemical Information

(2S)-2-(2-chlorophenyl)oxirane
CAS Number141394-10-7
PubChem CID12561900
IUPAC Name(2S)-2-(2-chlorophenyl)oxirane
Molecular FormulaC8H7ClO
Molecular Weight154.59
XLogP2
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity126
SMILES
C1[C@@H](O1)C2=CC=CC=C2Cl
InChI
InChI=1S/C8H7ClO/c9-7-4-2-1-3-6(7)8-5-10-8/h1-4,8H,5H2/t8-/m1/s1
InChIKey
RTPJBMWUVSTBPC-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-(2-chlorophenyl)oxirane
CAS: 141394-10-7
CID: 12561900
Formula: C8H7ClO
MW: 154.59
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight154.59
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass154.0185425
Monoisotopic Mass154.0185425
Topological Polar Surface Area12.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity126
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