Name: Name:2-Butenoic acid, 4-[(4-chlorophenyl)amino]-4-oxo-, (2Z)-
Brand: Angene
SKU: AG00FACW
Rating: 90 (10 reviews)

2-Butenoic acid, 4-[(4-chlorophenyl)amino]-4-oxo-, (2Z)-

CAS No.:

7242-16-2

Catalog Number:

AG00FACW

Molecular Formula:

C10H8ClNO3

Molecular Weight:

225.6284

Catalog Number:

AG00FACW

Chemical Name:

2-Butenoic acid, 4-[(4-chlorophenyl)amino]-4-oxo-, (2Z)-

CAS Number:

7242-16-2

Molecular Formula:

C10H8ClNO3

Molecular Weight:

225.6284

MDL Number:

MFCD00020472

IUPAC Name:

(Z)-4-(4-chloroanilino)-4-oxobut-2-enoic acid

InChI:

InChI=1S/C10H8ClNO3/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(14)15/h1-6H,(H,12,13)(H,14,15)/b6-5-

InChI Key:

FBTQVXSNFILAQY-WAYWQWQTSA-N

SMILES:

O=C(Nc1ccc(cc1)Cl)/C=C\C(=O)O

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.019g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.628g/mol

Monoisotopic Mass:

225.019g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5