1CI

1-(4-CHLOROPHENYL)-1H-IMIDAZOLE

Created:	2007-06-15
Last modified:	2011-06-04

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2 entries where 1CI is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	12

2D diagram of 1CI

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Chemical Component Summary
Name	1-(4-CHLOROPHENYL)-1H-IMIDAZOLE
Systematic Name (OpenEye OEToolkits)	1-(4-chlorophenyl)imidazole
Formula	C₉ H₇ Cl N₂
Molecular Weight	178.618
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Clc1ccc(cc1)n2ccnc2
SMILES	CACTVS	3.341	Clc1ccc(cc1)n2ccnc2
SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1n2ccnc2)Cl
Canonical SMILES	CACTVS	3.341	Clc1ccc(cc1)n2ccnc2
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1n2ccnc2)Cl
InChI	InChI	1.03	InChI=1S/C9H7ClN2/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h1-7H
InChIKey	InChI	1.03	BARLRKAYTDVUIS-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	142859
ChEMBL	CHEMBL1229718

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