Name: Name:Benzoic acid, 3-(acetylamino)-5-chloro-2-hydroxy-, ethyl ester
Brand: Angene
SKU: AG001ARL
Rating: 90 (10 reviews)

Benzoic acid, 3-(acetylamino)-5-chloro-2-hydroxy-, ethyl ester

CAS No.:

139329-90-1

Catalog Number:

AG001ARL

Molecular Formula:

C11H12ClNO4

Molecular Weight:

257.6703

Catalog Number:

AG001ARL

Chemical Name:

Benzoic acid, 3-(acetylamino)-5-chloro-2-hydroxy-, ethyl ester

CAS Number:

139329-90-1

Molecular Formula:

C11H12ClNO4

Molecular Weight:

257.6703

MDL Number:

MFCD28902469

IUPAC Name:

ethyl 3-acetamido-5-chloro-2-hydroxybenzoate

InChI:

InChI=1S/C11H12ClNO4/c1-3-17-11(16)8-4-7(12)5-9(10(8)15)13-6(2)14/h4-5,15H,3H2,1-2H3,(H,13,14)

InChI Key:

HPOZRPLLDCOQPR-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc(Cl)cc(c1O)NC(=O)C

Complexity:

297

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.045g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.67g/mol

Monoisotopic Mass:

257.045g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1