Home Other Building Blocks Benzeneacetic acid, 2,3-difluoro-4-methyl-

Benzeneacetic acid, 2,3-difluoro-4-methyl-

CAS No.:
261763-47-7
Catalog Number:
AG002S38
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
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Product Description
Catalog Number:
AG002S38
Chemical Name:
Benzeneacetic acid, 2,3-difluoro-4-methyl-
CAS Number:
261763-47-7
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
MDL Number:
MFCD01631649
IUPAC Name:
2-(2,3-difluoro-4-methylphenyl)acetic acid
InChI:
InChI=1S/C9H8F2O2/c1-5-2-3-6(4-7(12)13)9(11)8(5)10/h2-3H,4H2,1H3,(H,12,13)
InChI Key:
XYMLKJRXFGXFCJ-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(c(c1F)F)C
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.049g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.158g/mol
Monoisotopic Mass:
186.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties