CAS 618-73-5 | 3,4,5-Trihydroxybenzamide | CAS Number 618-73-5

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618-73-5 | 3,4,5-Trihydroxybenzamide

CAS No: 618-73-5 Catalog No: AG0033HZ MDL No:

Product Description

Catalog Number:

AG0033HZ

Chemical Name:

3,4,5-Trihydroxybenzamide

CAS Number:

618-73-5

Molecular Formula:

C7H7NO4

Molecular Weight:

169.1348

IUPAC Name:

3,4,5-trihydroxybenzamide

InChI:

InChI=1S/C7H7NO4/c8-7(12)3-1-4(9)6(11)5(10)2-3/h1-2,9-11H,(H2,8,12)

InChI Key:

RBQIPEJXQPQFJX-UHFFFAOYSA-N

SMILES:

NC(=O)c1cc(O)c(c(c1)O)O

EC Number:

210-561-5

NSC Number:

1124

Properties

Complexity:

172

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

169.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

169.136g/mol

Monoisotopic Mass:

169.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

104A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Structure-activity relationship of bis-galloyl derivatives related to (-)-epigallocatechin gallate.	Chemical & pharmaceutical bulletin 20090201
Antiproliferative and apoptosis-inducing activities of alkyl gallate and gallamide derivatives related to (-)-epigallocatechin gallate.	Bioorganic & medicinal chemistry 20080901
Diethylene glycol ether-linked 3,4,5-trihydroxybenzamides as triply branched dendritic anchors to CdSe/ZnS core/shell type nanoparticles: potential hydrophilic fluorescent probes.	Chemical communications (Cambridge, England) 20050521