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Structure

[2,5-Dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]acetonitrile

CAS
42780-50-7
Catalog Number
ACM42780507
Category
Other Products
Molecular Weight
224.300940 [g/mol]
Molecular Formula
C15H16N2

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Specification

Synonyms
MolPort-002-469-523, ZINC03888865, HMS1735D03, CID4962887, EN300-14192, 42780-50-7
IUPAC Name
2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]acetonitrile
Canonical SMILES
CC1=CC=C(C=C1)N2C(=CC(=C2C)CC#N)C
InChI Key
OMOHSRIDEFLEOH-UHFFFAOYSA-N
Boiling Point
385.2ºC at 760mmHg
Flash Point
186.7ºC
Density
1.01g/cm³
Exact Mass
224.13100
H-Bond Acceptor
1
H-Bond Donor
0
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