CAS 7743-39-7 | 3,5-Diacetamidobenzoic acid | CAS Number 7743-39-7

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7743-39-7 | 3,5-Diacetamidobenzoic acid

CAS No: 7743-39-7 Catalog No: AG005LLV MDL No:MFCD00026136

Product Description

Catalog Number:

AG005LLV

Chemical Name:

3,5-Diacetamidobenzoic acid

CAS Number:

7743-39-7

Molecular Formula:

C11H12N2O4

Molecular Weight:

236.2240

MDL Number:

MFCD00026136

IUPAC Name:

3,5-diacetamidobenzoic acid

InChI:

InChI=1S/C11H12N2O4/c1-6(14)12-9-3-8(11(16)17)4-10(5-9)13-7(2)15/h3-5H,1-2H3,(H,12,14)(H,13,15)(H,16,17)

InChI Key:

GEDTXYBZWNEYAB-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1cc(NC(=O)C)cc(c1)C(=O)O

EC Number:

231-804-1

NSC Number:

369057

Properties

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.227g/mol

Monoisotopic Mass:

236.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2

Literature

Title	Journal
Biogenic palladium enhances diatrizoate removal from hospital wastewater in a microbial electrolysis cell.	Environmental science & technology 20110701
Anti-Leishmanial activity of homo- and heteroleptic bismuth(III) carboxylates.	Journal of inorganic biochemistry 20110301