Home Other Building Blocks 3,4,5-Trihydroxybenzamide

3,4,5-Trihydroxybenzamide

CAS No.:
618-73-5
Catalog Number:
AG0033HZ
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
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Product Description
Catalog Number:
AG0033HZ
Chemical Name:
3,4,5-Trihydroxybenzamide
CAS Number:
618-73-5
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
MDL Number:
MFCD00014800
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:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
169.136g/mol
Monoisotopic Mass:
169.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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
Properties