Name: Name:4-[(1S)-1-amino-2,2,2-trifluoroethyl]benzonitrile hydrochloride
Brand: Angene
SKU: AG003AQJ
Rating: 90 (10 reviews)

4-[(1S)-1-amino-2,2,2-trifluoroethyl]benzonitrile hydrochloride

CAS No.:

943731-61-1

Catalog Number:

AG003AQJ

Molecular Formula:

C9H8ClF3N2

Molecular Weight:

236.6214

Catalog Number:

AG003AQJ

Chemical Name:

4-[(1S)-1-amino-2,2,2-trifluoroethyl]benzonitrile hydrochloride

CAS Number:

943731-61-1

Molecular Formula:

C9H8ClF3N2

Molecular Weight:

236.6214

MDL Number:

MFCD24410915

IUPAC Name:

4-[(1S)-1-amino-2,2,2-trifluoroethyl]benzonitrile;hydrochloride

InChI:

InChI=1S/C9H7F3N2.ClH/c10-9(11,12)8(14)7-3-1-6(5-13)2-4-7;/h1-4,8H,14H2;1H/t8-;/m0./s1

InChI Key:

YPALTFQCHARPGS-QRPNPIFTSA-N

SMILES:

N[C@H](C(F)(F)F)c1ccc(cc1)C#N.Cl

Complexity:

232

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.622g/mol

Monoisotopic Mass:

236.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: