Home Other Building Blocks 2-(2,5-difluoro-4-methylphenyl)acetic acid

2-(2,5-difluoro-4-methylphenyl)acetic acid

CAS No.:
1506547-77-8
Catalog Number:
AG01AUF1
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
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Product Description
Catalog Number:
AG01AUF1
Chemical Name:
2-(2,5-difluoro-4-methylphenyl)acetic acid
CAS Number:
1506547-77-8
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
MDL Number:
MFCD23843634
IUPAC Name:
2-(2,5-difluoro-4-methylphenyl)acetic acid
InChI:
InChI=1S/C9H8F2O2/c1-5-2-8(11)6(3-7(5)10)4-9(12)13/h2-3H,4H2,1H3,(H,12,13)
InChI Key:
LRFVKQDMWWDUPG-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc(F)c(cc1F)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