MT0

1-CHLORO-4-METHYLPHTHALAZINE

Created:2010-05-07
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count19
Chiral Atom Count0
Bond Count20
Aromatic Bond Count11
2D diagram of MT0

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Chemical Component Summary

Name1-CHLORO-4-METHYLPHTHALAZINE
Systematic Name (OpenEye OEToolkits)1-chloro-4-methyl-phthalazine
FormulaC9 H7 Cl N2
Molecular Weight178.618
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc2nnc(c1c2cccc1)C
SMILESCACTVS3.352Cc1nnc(Cl)c2ccccc12
SMILESOpenEye OEToolkits1.6.1Cc1c2ccccc2c(nn1)Cl
Canonical SMILESCACTVS3.352 Cc1nnc(Cl)c2ccccc12
Canonical SMILESOpenEye OEToolkits1.6.1 Cc1c2ccccc2c(nn1)Cl
InChIInChI1.03 InChI=1S/C9H7ClN2/c1-6-7-4-2-3-5-8(7)9(10)12-11-6/h2-5H,1H3
InChIKeyInChI1.03 IEDBAGGSOLFBBH-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 269733