Home Other Building Blocks 2-(3,4-difluorophenyl)oxirane

2-(3,4-difluorophenyl)oxirane

CAS No.:
111991-13-0
Catalog Number:
AG003ESV
Molecular Formula:
C8H6F2O
Molecular Weight:
156.1294
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Product Description
Catalog Number:
AG003ESV
Chemical Name:
2-(3,4-difluorophenyl)oxirane
CAS Number:
111991-13-0
Molecular Formula:
C8H6F2O
Molecular Weight:
156.1294
MDL Number:
MFCD09728790
IUPAC Name:
2-(3,4-difluorophenyl)oxirane
InChI:
InChI=1S/C8H6F2O/c9-6-2-1-5(3-7(6)10)8-4-11-8/h1-3,8H,4H2
InChI Key:
UNJRFWWCCAHSRB-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1F)C1CO1
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.132g/mol
Monoisotopic Mass:
156.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties