Cas no 101494-93-3 (3(2H)-Cinnolinone,7-chloro-)
3(2H)-Cinnolinone,7-chloro- structure
Product Name:3(2H)-Cinnolinone,7-chloro-
CAS No:101494-93-3
MF:C8H5ClN2O
MW:180.59110045433
CID:124669
PubChem ID:251652
Update Time:2025-04-18
3(2H)-Cinnolinone,7-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 3(2H)-Cinnolinone,7-chloro-
- 7-chloro-2H-cinnolin-3-one
- 7-Chlor-3-cinnolinol
- 7-Chlor-cinnolin-ol-(3)
- 7-Chloro-3-cinnolinol
- 7-chlorocinnolin-3(2h)-one
- 7-Chlorocinnolin-3-ol
- AC1L5KBN
- ACMC-20m4jg
- NSC72288
- SureCN1574290
- AMY32140
- DTXSID70290991
- NSC-72288
- 101494-93-3
- 7-Chloro-3(2H)-cinnolinone
- AKOS006315430
- A800396
- SCHEMBL1574290
-
- Inchi： 1S/C8H5ClN2O/c9-6-2-1-5-3-8(12)11-10-7(5)4-6/h1-4H,(H,11,12)
- InChI Key： XWBNQJIVYPOBNF-UHFFFAOYSA-N
- SMILES： ClC1C=CC2=CC(NN=C2C=1)=O
Computed Properties
- Exact Mass: 180.00915
- Monoisotopic Mass: 180.009
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 363
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 41.5A^2
Experimental Properties
- Density: 1.50
- Boiling Point: 383 °C at 760 mmHg
- Flash Point: 185.4 °C
- PSA: 41.46
- LogP: 1.98880
3(2H)-Cinnolinone,7-chloro- Related Literature
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
101494-93-3 (3(2H)-Cinnolinone,7-chloro-) Related Products
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- 5468-36-0(2,3,5,6,7,8-hexahydrocinnolin-3-one)
- 61404-50-0(5-ethyl-2,3-dihydropyridazin-3-one)
- 54709-94-3(5-Methylpyridazin-3(2H)-one)
- 73619-57-5(6-Methylpyridazin-3-one)
- 7143-82-0(3-methyl-1H-pyridazin-6-one;hydrate)
- 31777-46-5(2,3-dihydrocinnolin-3-one)
- 2728-01-0(3(2H)-Pyridazinone,5-ethyl-4-methyl-)
- 5155-77-1(3(2H)-Cinnolinone,2-(phenylmethyl)-)
- 7007-92-3(4,6-dimethyl-2,3-dihydropyridazin-3-one)
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