710296-43-8
1-(3-CHLORO-2-METHYLPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
Name1-(3-CHLORO-2-METHYLPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
pro_formulaC14 H14 Cl N O
1Identification
【Name】
1-(3-CHLORO-2-METHYLPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
【CAS】
【MDL】
MFCD02629498
【EnglishSynonyms】
【pro_formula】
C14 H14 Cl N O
【pro_molWeight】
247.724
【Inchi】
InChI=1S/C14H14ClNO/c1-9-7-12(8-17)11(3)16(9)14-6-4-5-13(15)10(14)2/h4-8H,1-3H3
【InChIKey】
InChIKey=GAARVPDOFYSWAV-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(n1c2cccc(c2C)Cl)C)C=O
【MOL File】
1-(3-CHLORO-2-METHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(3-CHLORO-2-METHYLPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE.cml