Name: Name:2-(4-bromothiophen-2-yl)-2-[(2,2,2-trifluoroethyl)amino]acetic acid
Brand: Angene
SKU: AG019SXP
Rating: 90 (10 reviews)

2-(4-bromothiophen-2-yl)-2-[(2,2,2-trifluoroethyl)amino]acetic acid

CAS No.:

1250603-22-5

Catalog Number:

AG019SXP

Molecular Formula:

C8H7BrF3NO2S

Molecular Weight:

318.1109

Catalog Number:

AG019SXP

Chemical Name:

2-(4-bromothiophen-2-yl)-2-[(2,2,2-trifluoroethyl)amino]acetic acid

CAS Number:

1250603-22-5

Molecular Formula:

C8H7BrF3NO2S

Molecular Weight:

318.1109

MDL Number:

MFCD14632452

IUPAC Name:

2-(4-bromothiophen-2-yl)-2-(2,2,2-trifluoroethylamino)acetic acid

InChI:

InChI=1S/C8H7BrF3NO2S/c9-4-1-5(16-2-4)6(7(14)15)13-3-8(10,11)12/h1-2,6,13H,3H2,(H,14,15)

InChI Key:

SELWXVQTLWAOJS-UHFFFAOYSA-N

SMILES:

OC(=O)C(c1scc(c1)Br)NCC(F)(F)F

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.933g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

318.108g/mol

Monoisotopic Mass:

316.933g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3