264

(phenylamino)acetonitrile

Created:	2007-10-02
Last modified:	2011-06-04

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1 entries where 264 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	18
Chiral Atom Count	0
Bond Count	18
Aromatic Bond Count	6

2D diagram of 264

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Chemical Component Summary
Name	(phenylamino)acetonitrile
Systematic Name (OpenEye OEToolkits)	2-phenylazanylethanenitrile
Formula	C₈ H₈ N₂
Molecular Weight	132.163
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	N#CCNc1ccccc1
SMILES	CACTVS	3.341	N#CCNc1ccccc1
SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)NCC#N
Canonical SMILES	CACTVS	3.341	N#CCNc1ccccc1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)NCC#N
InChI	InChI	1.03	InChI=1S/C8H8N2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,10H,7H2
InChIKey	InChI	1.03	KAXCEFLQAYFJKV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	76372

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