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| CAS No.: | 60148-13-2 |
|---|---|
| Name: | 2-Isocyanomethylpridine |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C7H6N2 |
| Molecular Weight: | 118.138 |
| Synonyms: | 2-isocyanomethylpridine;2-PyridylMethyl isocyanide |
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Specification
This chemical is called 2-Isocyanomethylpridine, and it can also be named as pyridine, 2-(isocyanomethyl)-. With the molecular formula of C7H6N2, its molecular weight is 118.14. The CAS registry number of this chemical is 60148-13-2.
Other characteristics of the 2-Isocyanomethylpridine can be summarised as followings: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 17.25 Å2; (5)XLogP3: 0.6; (6)Rotatable Bond Coun:t 1; (7)Topological Polar Surface Area: 17.2; (8)Heavy Atom Count: 9; (9)Formal Charge: 0; (10)Complexity: 122; (11)Covalently-Bonded Unit Count: 1; (12)Feature 3D Acceptor Count: 1; (13)Feature 3D Ring Count: 1.
You can still convert the following datas into molecular structure:
(1)SMILES: [C-]#[N+]Cc1ncccc1
(2)InChI: InChI=1/C7H6N2/c1-8-6-7-4-2-3-5-9-7/h2-5H,6H2
(3)InChIKey: QDGBDMBHUVUXRL-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C7H6N2/c1-8-6-7-4-2-3-5-9-7/h2-5H,6H2
(5)Std. InChIKey: QDGBDMBHUVUXRL-UHFFFAOYSA-N