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Structure

1H-Pyrazole-4-carboxaldehyde,3,5-dimethyl-1-(phenylmethyl)-

CAS
2644-94-2
Catalog Number
ACM2644942
Category
Other Products
Molecular Weight
214.26
Molecular Formula
C13H14N2O

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Specification

Synonyms
STOCK4S-91543, MolPort-000-876-360, CID968934, STK125342, ZINC00586738, BAS 03395079, 1-Benzyl-3,5-dimethyl-1H-pyrazole-4-carbaldehyde, 2644-94-2
IUPAC Name
1-benzyl-3,5-dimethylpyrazole-4-carbaldehyde
Canonical SMILES
CC1=C(C(=NN1CC2=CC=CC=C2)C)C=O
InChI Key
KQZFABYWVRTOFK-UHFFFAOYSA-N
Boiling Point
376.7ºC at 760mmHg
Flash Point
181.6ºC
Density
1.09g/cm³
Exact Mass
214.11100
H-Bond Acceptor
2
H-Bond Donor
0
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