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CAS Number: 25016-12-0
1,3-dimethyl-1H-pyrazole-4-carbaldehyde

Structure

1,3-dimethyl-1H-pyrazole-4-carbaldehyde
Name: 1,3-dimethyl-1H-pyrazole-4-carbaldehyde
Synonyms:
General Information
Product Number: 25016120

CAS Registry Number 25016-12-0
Name:
1H-?Pyrazole-?4-?carboxaldehyde, 1,?3-?dimethyl-
Pyrazole-4-carboxaldehyde, 1,3-dimethyl- (8CI)
1,3-Dimethyl-1H-pyrazole-4-carboxaldehyde
1,3-Dimethyl-4-formylpyrazole
1,3-Dimethylpyrazole-4-carboxaldehyde

 

Chemical Formula: C6H8N2O
Exact Mass: 124.06
Molecular Weight: 124.14
m/z: 124.06 (100.0%), 125.07 (6.6%)

 

InChI;InChI=1S/C6H8N2O/c1-5-6(4-9)3-8(2)7-5/h3-4H,1-2H3

InChI Key:IGJREDVLGVEPFI-UHFFFAOYSA-N

Canonical SMILES:CC1=NN(C=C1C=O)C

 

Thermal Properties Value Condition Note
Boiling Point 98-100 °C Press: 760 Torr (1)IC
Melting Point 50 °C   (5)CAS
Melting Point See full text   (4)CAS

Specification

98%

References
  1. (1) Andreeva, M. A.; Zhurnal Obshchei Khimii 1980, V50(10), P2370-5 CAPLUS
  2. (4) Park, Min-Sup; Synthetic Communications 2004, V34(9), P1541-1550 CAPLUS
  3. (5) Attaryan, O. S.; Russian Journal of Organic Chemistry 2007, V43(11), P1740-1741 CAPLUS
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