Name: Name:4-[(pyrimidin-2-yl)amino]benzoic acid hydrochloride
Brand: Angene
SKU: AG01ELML
Rating: 90 (10 reviews)

4-[(pyrimidin-2-yl)amino]benzoic acid hydrochloride

CAS No.:

2138545-42-1

Catalog Number:

AG01ELML

Molecular Formula:

C11H10ClN3O2

Molecular Weight:

251.6690

Catalog Number:

AG01ELML

Chemical Name:

4-[(pyrimidin-2-yl)amino]benzoic acid hydrochloride

CAS Number:

2138545-42-1

Molecular Formula:

C11H10ClN3O2

Molecular Weight:

251.6690

MDL Number:

MFCD31559293

IUPAC Name:

4-(pyrimidin-2-ylamino)benzoic acid;hydrochloride

InChI:

InChI=1S/C11H9N3O2.ClH/c15-10(16)8-2-4-9(5-3-8)14-11-12-6-1-7-13-11;/h1-7H,(H,15,16)(H,12,13,14);1H

InChI Key:

VJZRVAGGDZTGIR-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccc(cc1)Nc1ncccn1.Cl

Complexity:

233

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

251.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.67g/mol

Monoisotopic Mass:

251.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: