Name: Name:Alanine, N-[(5-chloro-2-thienyl)carbonyl]-2-methyl-
Brand: Angene
SKU: AG004O72
Rating: 90 (10 reviews)

Alanine, N-[(5-chloro-2-thienyl)carbonyl]-2-methyl-

CAS No.:

869548-36-7

Catalog Number:

AG004O72

Molecular Formula:

C9H10ClNO3S

Molecular Weight:

247.6986

Catalog Number:

AG004O72

Chemical Name:

Alanine, N-[(5-chloro-2-thienyl)carbonyl]-2-methyl-

CAS Number:

869548-36-7

Molecular Formula:

C9H10ClNO3S

Molecular Weight:

247.6986

MDL Number:

MFCD14608262

IUPAC Name:

2-[(5-chlorothiophene-2-carbonyl)amino]-2-methylpropanoic acid

InChI:

InChI=1S/C9H10ClNO3S/c1-9(2,8(13)14)11-7(12)5-3-4-6(10)15-5/h3-4H,1-2H3,(H,11,12)(H,13,14)

InChI Key:

IGAXWPNGVZMKQB-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(s1)Cl)NC(C(=O)O)(C)C

Complexity:

283

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.007g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.693g/mol

Monoisotopic Mass:

247.007g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4