Cas no 1009-13-8 (Benzene, 1,4-diisocyano-2,5-dimethyl-)
1009-13-8 structure
Product Name:Benzene, 1,4-diisocyano-2,5-dimethyl-
CAS No:1009-13-8
MF:C10H8N2
MW:156.183921813965
CID:1126536
PubChem ID:71355830
Update Time:2025-04-20
Benzene, 1,4-diisocyano-2,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,4-diisocyano-2,5-dimethyl-
- 1,4-diisocyano-2,5-dimethylbenzene
- 1009-13-8
- 1,4-diisonitrile-2,5-dimethylbenzene
- DTXSID00780077
-
- Inchi： 1S/C10H8N2/c1-7-5-10(12-4)8(2)6-9(7)11-3/h5-6H,1-2H3
- InChI Key： SDQKKARBNKSZQR-UHFFFAOYSA-N
- SMILES： [N+](#[C-])C1C=C(C)C(=CC=1C)[N+]#[C-]
Computed Properties
- Exact Mass: 156.06884
- Monoisotopic Mass: 156.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 224
- 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: 2.1
- Topological Polar Surface Area: 8.7?2
Experimental Properties
- PSA: 8.72
- LogP: 1.86640
Benzene, 1,4-diisocyano-2,5-dimethyl- Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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