1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid

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Catalog Number
ACM1125297
Product Name
1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid
Structure
Structure
CAS
1125-29-7
Category
Heterocyclic Organic Compound
Description
1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid is a marine derived natural products found in Cinachyrella sp.
Synonyms
4-Carboxy-1,3,5-trimethyl-1H-pyrazole
IUPAC Name
1,3,5-Trimethylpyrazole-4-carboxylic acid
Molecular Weight
154.17
Molecular Formula
C7H10N2O2
Canonical SMILES
CC1=C(C(=NN1C)C)C(=O)O
InChI
InChI=1S/C7H10N2O2/c1-4-6(7(10)11)5(2)9(3)8-4/h1-3H3,(H,10,11)
InChI Key
NOIOGQJFLIPRBI-UHFFFAOYSA-N
Boiling Point
297.6±35.0 °C
Melting Point
215-217 °C
Density
1.24±0.1 g/cm³
Complexity
172
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Exact Mass
154.074227566
Heavy Atom Count
11
Monoisotopic Mass
154.074227566
Physical State
Powder
Storage Conditions
Powder: -20°C for 3 years In solvent: -80°C for 2 years
Topological Polar Surface Area
55.1 Ų
MSDS
Download MSDS
COA
Download COA
Spec Sheet
Download Spec Sheet
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