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1157642-22-2 | Cyclopropanecarboxylic acid, 2-(2,4-difluorophenyl)-
CAS No: 1157642-22-2 Catalog No: AG000GUE MDL No:MFCD12068249
Product Description
Catalog Number:
AG000GUE
Chemical Name:
Cyclopropanecarboxylic acid, 2-(2,4-difluorophenyl)-
CAS Number:
1157642-22-2
Molecular Formula:
C10H8F2O2
Molecular Weight:
198.1661
MDL Number:
MFCD12068249
IUPAC Name:
2-(2,4-difluorophenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H8F2O2/c11-5-1-2-6(9(12)3-5)7-4-8(7)10(13)14/h1-3,7-8H,4H2,(H,13,14)
InChI Key:
RPXLAIOPAHDAFN-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC1c1ccc(cc1F)F
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.169g/mol
Monoisotopic Mass:
198.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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