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1010-60-2 | 1,4-Naphthalenedione, 2-chloro-
CAS No: 1010-60-2 Catalog No: AG0003GB MDL No:MFCD00029187
Product Description
Catalog Number:
AG0003GB
Chemical Name:
1,4-Naphthalenedione, 2-chloro-
CAS Number:
1010-60-2
Molecular Formula:
C10H5ClO2
Molecular Weight:
192.5985
MDL Number:
MFCD00029187
IUPAC Name:
2-chloronaphthalene-1,4-dione
InChI:
InChI=1S/C10H5ClO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H
InChI Key:
CCTJHVLTAJTPBV-UHFFFAOYSA-N
SMILES:
O=C1C=C(Cl)C(=O)c2c1cccc2
EC Number:
213-776-2
UNII:
FOF3PSJ59Z
NSC Number:
400597
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.998g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.598g/mol
Monoisotopic Mass:
191.998g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| On the search for potential anti-Trypanosoma cruzi drugs: synthesis and biological evaluation of 2-hydroxy-3-methylamino and 1,2,3-triazolic naphthoquinoidal compounds obtained by click chemistry reactions. | European journal of medicinal chemistry 20120601 |
| Synthesis and biological evaluation of naphthoquinone analogs as a novel class of proteasome inhibitors. | Bioorganic & medicinal chemistry 20100801 |
| 2-Ferrocenyl-N-(2-ferrocenylbenzo-yl)-N-(4-methyl-2-pyrid-yl)benzamide. | Acta crystallographica. Section E, Structure reports online 20090301 |
| 2-Fluoro-N-(2-fluoro-benzo-yl)-N-(2-pyrid-yl)benzamide. | Acta crystallographica. Section E, Structure reports online 20090301 |
| N-(3-Bromo-1,4-dioxo-1,4-dihydro-2-naphth-yl)-2-chloro-N-(2-chloro-benzoyl)benzamide. | Acta crystallographica. Section E, Structure reports online 20090101 |
| 2-Chloro-3-(4-chloro-benzamido)-1,4-naphthoquinone. | Acta crystallographica. Section E, Structure reports online 20090101 |
| Effect of methoxyl group position on the regioselectivity of ammonia substitution reactions involving 3,3'-dichloro-2,2'-binaphthoquinones. | The Journal of organic chemistry 20040723 |
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