Home Carboxys 2-(3,4-difluorophenyl)cyclopropanecarboxylic acid

2-(3,4-difluorophenyl)cyclopropanecarboxylic acid

CAS No.:
1157561-73-3
Catalog Number:
AG00976O
Molecular Formula:
C10H8F2O2
Molecular Weight:
198.1661
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Product Description
Catalog Number:
AG00976O
Chemical Name:
2-(3,4-difluorophenyl)cyclopropanecarboxylic acid
CAS Number:
1157561-73-3
Molecular Formula:
C10H8F2O2
Molecular Weight:
198.1661
MDL Number:
MFCD12068235
IUPAC Name:
2-(3,4-difluorophenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H8F2O2/c11-8-2-1-5(3-9(8)12)6-4-7(6)10(13)14/h1-3,6-7H,4H2,(H,13,14)
InChI Key:
CSLVZAGSOJLXCT-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC1c1ccc(c(c1)F)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  
Properties