Name: Name:Benzoic acid, 2-amino-6-(trifluoromethyl)-, hydrochloride (1:1)
Brand: Angene
SKU: AG00IGX7
Rating: 90 (10 reviews)

Benzoic acid, 2-amino-6-(trifluoromethyl)-, hydrochloride (1:1)

CAS No.:

918667-28-4

Catalog Number:

AG00IGX7

Molecular Formula:

C8H7ClF3NO2

Molecular Weight:

241.5949

Catalog Number:

AG00IGX7

Chemical Name:

Benzoic acid, 2-amino-6-(trifluoromethyl)-, hydrochloride (1:1)

CAS Number:

918667-28-4

Molecular Formula:

C8H7ClF3NO2

Molecular Weight:

241.5949

MDL Number:

MFCD30729973

IUPAC Name:

2-amino-6-(trifluoromethyl)benzoic acid;hydrochloride

InChI:

InChI=1S/C8H6F3NO2.ClH/c9-8(10,11)4-2-1-3-5(12)6(4)7(13)14;/h1-3H,12H2,(H,13,14);1H

InChI Key:

YGSNRIVWQPNEIT-UHFFFAOYSA-N

SMILES:

OC(=O)c1c(N)cccc1C(F)(F)F.Cl

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.012g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.594g/mol

Monoisotopic Mass:

241.012g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: