Name: Name:[(4-{[(carboxymethyl)amino]carbonyl}benzoyl)amino]acetic acid
Brand: Angene
SKU: AG007OB4
Rating: 90 (10 reviews)

[(4-{[(carboxymethyl)amino]carbonyl}benzoyl)amino]acetic acid

CAS No.:

22578-94-5

Catalog Number:

AG007OB4

Molecular Formula:

C12H12N2O6

Molecular Weight:

280.2335

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Product Description

Catalog Number:

AG007OB4

Chemical Name:

[(4-{[(carboxymethyl)amino]carbonyl}benzoyl)amino]acetic acid

CAS Number:

22578-94-5

Molecular Formula:

C12H12N2O6

Molecular Weight:

280.2335

MDL Number:

MFCD00044039

IUPAC Name:

2-[[4-(carboxymethylcarbamoyl)benzoyl]amino]acetic acid

InChI:

InChI=1S/C12H12N2O6/c15-9(16)5-13-11(19)7-1-2-8(4-3-7)12(20)14-6-10(17)18/h1-4H,5-6H2,(H,13,19)(H,14,20)(H,15,16)(H,17,18)

InChI Key:

SNKLTOILIHVGIH-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(cc1)C(=O)NCC(=O)O)NCC(=O)O

EC Number:

245-099-3

NSC Number:

141191

Properties

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.07g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.236g/mol

Monoisotopic Mass:

280.07g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

133A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.3

Literature

Title	Journal
Interpenetrated networks from a novel nanometer-sized pseudopeptidic ligand, bridging water, and transition metal ions with cds topology.	Chemical communications (Cambridge, England) 20050814

Properties