265

2-nitrothiophene

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

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1 entries where 265 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	11
Chiral Atom Count	0
Bond Count	11
Aromatic Bond Count	5

2D diagram of 265

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Chemical Component Summary
Name	2-nitrothiophene
Systematic Name (OpenEye OEToolkits)	2-nitrothiophene
Formula	C₄ H₃ N O₂ S
Molecular Weight	129.137
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	[O-][N+](=O)c1sccc1
SMILES	CACTVS	3.341	[O-][N+](=O)c1sccc1
SMILES	OpenEye OEToolkits	1.5.0	c1cc(sc1)[N+](=O)[O-]
Canonical SMILES	CACTVS	3.341	[O-][N+](=O)c1sccc1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(sc1)[N+](=O)[O-]
InChI	InChI	1.03	InChI=1S/C4H3NO2S/c6-5(7)4-2-1-3-8-4/h1-3H
InChIKey	InChI	1.03	JIZRGGUCOQKGQD-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	11866

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