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6954-29-6 | Benzaldehyde,3,3'-sulfonylbis[6-hydroxy-
CAS No: 6954-29-6 Catalog No: AG005KUQ MDL No:
Product Description
Catalog Number:
AG005KUQ
Chemical Name:
Benzaldehyde,3,3'-sulfonylbis[6-hydroxy-
CAS Number:
6954-29-6
Molecular Formula:
C14H10O6S
Molecular Weight:
306.2906
IUPAC Name:
5-(3-formyl-4-hydroxyphenyl)sulfonyl-2-hydroxybenzaldehyde
InChI:
InChI=1S/C14H10O6S/c15-7-9-5-11(1-3-13(9)17)21(19,20)12-2-4-14(18)10(6-12)8-16/h1-8,17-18H
InChI Key:
NRBDZRMCFXNSFF-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1O)S(=O)(=O)c1ccc(c(c1)C=O)O
NSC Number:
38049
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.02g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
306.288g/mol
Monoisotopic Mass:
306.02g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Diarylsulfones, a novel class of human immunodeficiency virus type 1 integrase inhibitors. | Antimicrobial agents and chemotherapy 19970201 |
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