Cas no 10278-20-3 (Benzoyl isocyanate, 3,4-dichloro-)
10278-20-3 structure
Product Name:Benzoyl isocyanate, 3,4-dichloro-
CAS No:10278-20-3
MF:C8H3Cl2NO2
MW:216.020920038223
CID:1133783
PubChem ID:20252642
Update Time:2025-04-20
Benzoyl isocyanate, 3,4-dichloro- Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl isocyanate, 3,4-dichloro-
- 3,4-dichlorobenzoyl isocyanate
- AKOS022305665
- 10278-20-3
- DTXSID70604155
- SCHEMBL10999100
-
- Inchi： 1S/C8H3Cl2NO2/c9-6-2-1-5(3-7(6)10)8(13)11-4-12/h1-3H
- InChI Key： LNAMONHYXJTAHL-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC(C(N=C=O)=O)=C1)Cl
Computed Properties
- Exact Mass: 242.0579
- Monoisotopic Mass: 214.9540837g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 251
- 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: 4.6
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 52.6
- LogP: 2.46940
Benzoyl isocyanate, 3,4-dichloro- Related Literature
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
10278-20-3 (Benzoyl isocyanate, 3,4-dichloro-) Related Products
- 4461-33-0(benzoyl isocyanate)
- 239439-25-9(Benzamide,N-(2-methoxyethylidene)-)
- 16794-68-6(4-Methylbenzoyl Isothiocyanate)
- 18354-35-3(Benzoyl isocyanate,4-fluoro-)
- 532-55-8(N-Benzoyl Isothiocyanate)
- 26971-98-2(3-Pyridinecarbonylisocyanate)
- 60731-73-9(2,6-Difluorobenzoylisocyanate)
- 25410-16-6(Benzamide,N-carbonimidoyl- (9CI))
- 28115-85-7(2-Methylbenzoyl isothiocyanate)
- 179600-42-1(Benzamide,N-1-propen-1-ylidene-)
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