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CAS No.: | 935-16-0 |
---|---|
Name: | 1,4-DIISOCYANOBENZENE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C8H4N2 |
Molecular Weight: | 128.133 |
Synonyms: | p-Phenyleneisocyanide (7CI,8CI);1,4-Diisocyanobenzene;1,4-Phenylene diisocyanide;Phenylene-1,4-bisisocyanide;p-Diisocyanobenzene;p-Phenyl diisocyanide; |
Melting Point: | 160 °C (dec.)(lit.) |
Hazard Symbols: | Xn |
Risk Codes: | 20/21/22-36/37/38 |
Safety: | 26 |
PSA: | 0.00000 |
LogP: | 1.24960 |
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The Benzene,1,4-diisocyano-, with CAS registry number 935-16-0, belongs to the following product category: Isonitrite. It has the systematic name of 1,4-diisocyanobenzene. Besides this, it is also called p-Phenylene diisocyanide. And the chemical formula of this chemical is C8H4N2.
Physical properties of Benzene,1,4-diisocyano-: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 0; (4)Polar Surface Area: 8.72 Å2.
When you are using this chemical, please be cautious about it as the following:
The Benzene,1,4-diisocyano- irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: [C-]#[N+]c1ccc([N+]#[C-])cc1
(2)InChI: InChI=1/C8H4N2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H
(3)InChIKey: IXACFSRTSHAQIX-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H4N2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H
(5)Std. InChIKey: IXACFSRTSHAQIX-UHFFFAOYSA-N