200,000+ products from a single source!
sales@angenechem.com
102583-96-0 | Benzoic acid, 2-[[2,5-bis(trifluoromethyl)phenyl]amino]-
CAS No: 102583-96-0 Catalog No: AG0007TR MDL No:
Product Description
Catalog Number:
AG0007TR
Chemical Name:
Benzoic acid, 2-[[2,5-bis(trifluoromethyl)phenyl]amino]-
CAS Number:
102583-96-0
Molecular Formula:
C15H9F6NO2
Molecular Weight:
349.2279
IUPAC Name:
2-[2,5-bis(trifluoromethyl)anilino]benzoic acid
InChI:
InChI=1S/C15H9F6NO2/c16-14(17,18)8-5-6-10(15(19,20)21)12(7-8)22-11-4-2-1-3-9(11)13(23)24/h1-7,22H,(H,23,24)
InChI Key:
QDYFUXCKCBIGFN-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1Nc1cc(ccc1C(F)(F)F)C(F)(F)F
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.054g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
349.232g/mol
Monoisotopic Mass:
349.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.