Name: Name:Benzenebutanoic acid, 4-fluoro-5-methyl-2-nitro-
Brand: Angene
SKU: AG002KPX
Rating: 90 (10 reviews)

Benzenebutanoic acid, 4-fluoro-5-methyl-2-nitro-

CAS No.:

210346-38-6

Catalog Number:

AG002KPX

Molecular Formula:

C11H12FNO4

Molecular Weight:

241.2157

Catalog Number:

AG002KPX

Chemical Name:

Benzenebutanoic acid, 4-fluoro-5-methyl-2-nitro-

CAS Number:

210346-38-6

Molecular Formula:

C11H12FNO4

Molecular Weight:

241.2157

MDL Number:

MFCD09955363

IUPAC Name:

4-(4-fluoro-5-methyl-2-nitrophenyl)butanoic acid

InChI:

InChI=1S/C11H12FNO4/c1-7-5-8(3-2-4-11(14)15)10(13(16)17)6-9(7)12/h5-6H,2-4H2,1H3,(H,14,15)

InChI Key:

FLDSODKYHOICTB-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(F)c(cc1CCCC(=O)O)C

Complexity:

292

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.218g/mol

Monoisotopic Mass:

241.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3