Methyl 1-((1H-pyrazol-1-yl)methyl)-1H-pyrazole-3-carboxylate
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Basic information
- CAS
1001499-89-3- Standard SMILES
COC(=O)c1ccn(Cn2cccn2)n1- InChIKey
HYWBWOUBWTVXJI-UHFFFAOYSA-N- Molecular formula
- C9H10N4O2
- Average molar mass
- 206.2 g/mol
- Monoisotopic mass
- 206.08037557
Names & identifiers
- Preferred name
- Methyl 1-((1H-pyrazol-1-yl)methyl)-1H-pyrazole-3-carboxylate
- IUPAC
- methyl 1-(pyrazol-1-ylmethyl)pyrazole-3-carboxylate
- English name
- 1-PYRAZOL-1-YLMETHYL-1 H-PYRAZOLE-3-CARBOXYLIC ACID METHYL ESTER
- Molecular formula
- C9H10N4O2
- Molecular weight
- 206.2
Names & synonyms
1001499-89-3Methyl 1-((1H-pyrazol-1-yl)methyl)-1H-pyrazole-3-carboxylatemethyl 1-(1H-pyrazol-1-ylmethyl)-1H-pyrazole-3-carboxylateMFCD04969137methyl 1-[(1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylatemethyl 1-(pyrazolylmethyl)pyrazole-3-carboxylate1-Pyrazol-1-ylmethyl-1H-pyrazole-3-carboxylic acid methyl estermethyl 1-(pyrazol-1-ylmethyl)pyrazole-3-carboxylateSCHEMBL23713995DTXSID1011939521-Pyrazol-1-ylmethyl-1 H -pyrazole-3-carboxylic acid methyl esterSBB021756
Show more names
AKOS B018605ART-CHEM-BB B0186051H-Pyrazole-3-carboxylic acid, 1-(1H-pyrazol-1-ylmethyl)-, methyl ester
STK312423AKOS000307870CS-0302006ST45091481EN300-229332F027123Methyl1-((1H-pyrazol-1-yl)methyl)-1H-pyrazole-3-carboxylate1-pyrazol-1-ylmethyl-1 h-pyrazole-3-carboxylic acid methyl ester
Database identifiers
- CAS
1001499-89-3- PubChem CID
- 7017459
- DTXSID
DTXSID101193952
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 236
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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