ethyl N-[3-(2-hydroxyethyl)-5-methyl-1H-pyrazol-4-yl]carbamate
Basic information
- CAS
72499-53-7- Standard SMILES
CCOC(=O)Nc1c(CCO)n[nH]c1C- InChIKey
RNLCQDDYAUBVBK-UHFFFAOYSA-N- Molecular formula
- C9H15N3O3
- Average molar mass
- 213.23 g/mol
- Monoisotopic mass
- 213.11134135
Names & identifiers
- Preferred name
- ethyl N-[3-(2-hydroxyethyl)-5-methyl-1H-pyrazol-4-yl]carbamate
- IUPAC
- ethyl N-[3-(2-hydroxyethyl)-5-methyl-1H-pyrazol-4-yl]carbamate
Names & synonyms
72499-53-7ethyl N-[3-(2-hydroxyethyl)-5-methyl-1H-pyrazol-4-yl]carbamateNSC345655DTXSID60319448NSC-345655Ethyl [3-(2-hydroxyethyl)-5-methyl-1H-pyrazol-4-yl]carbamate
Database identifiers
- CAS
72499-53-7- PubChem CID
- 335533
- DTXSID
DTXSID60319448
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 87.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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