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Cas Database

Name	3-(2-Isocyanoethyl)-1H-indole	EINECS	N/A
CAS No.	100571-64-0	Density	N/A
PSA	15.79000	LogP	1.86040
Solubility	N/A	Melting Point	N/A
Formula	C₁₁H₁₀N₂	Boiling Point	N/A
Molecular Weight	170.214	Flash Point	N/A
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	1H-Indole, 3-(2-isocyanoethyl)-;	Article Data	11

3-(2-Isocyanoethyl)-1H-indole Specification

The 3-(2-Isocyanoethyl)-1H-indole with cas registry number of 100571-64-0, whose systematic name is 3-(2-isocyanoethyl)-1H-indole. And it is also named 1H-Indole, 3-(2-isocyanoethyl)-; 2-(Indol-3-yl)ethylisocyanide.Physical properties about this chemical are: (1)#H bond acceptors: 2; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 9.29 Å².

You can still convert the following datas into molecular structure:
(1)SMILES:[C-]#[N+]CCc2c1ccccc1nc2;
(2)InChI:InChI=1/C11H10N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,13H,6-7H2;
(3)InChIKey:KKQMZQJNSZGLBO-UHFFFAOYAL;
(4)Std. InChI:InChI=1S/C11H10N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,13H,6-7H2;
(5)Std. InChIKey:KKQMZQJNSZGLBO-UHFFFAOYSA-N.

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