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Home Other Building Blocks 2-(3-Chloro-phenyl)-oxirane

2-(3-Chloro-phenyl)-oxirane

CAS No.:
20697-04-5
Catalog Number:
AG002IRL
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$94
- +
1g
97%
1 week
United States
$180
- +
Product Description
Catalog Number:
AG002IRL
Chemical Name:
2-(3-Chloro-phenyl)-oxirane
CAS Number:
20697-04-5
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
MDL Number:
MFCD01656983
IUPAC Name:
2-(3-chlorophenyl)oxirane
InChI:
InChI=1S/C8H7ClO/c9-7-3-1-2-6(4-7)8-5-10-8/h1-4,8H,5H2
InChI Key:
YVMKRPGFBQGEBF-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C1CO1
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.593g/mol
Monoisotopic Mass:
154.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Residue size at position 87 of cytochrome P450 BM-3 determines its stereoselectivity in propylbenzene and 3-chlorostyrene oxidation. FEBS letters 20011116
Properties