Ethyl 2-(1H-1,2,3-triazol-1-YL)acetate
Basic information
- CAS
4314-21-0- Standard SMILES
CCOC(=O)Cn1ccnn1- InChIKey
DAWFJGMMMBJQBB-UHFFFAOYSA-N- Molecular formula
- C6H9N3O2
- Average molar mass
- 155.15 g/mol
- Monoisotopic mass
- 155.06947654
Names & identifiers
- Preferred name
- Ethyl 2-(1H-1,2,3-triazol-1-YL)acetate
- IUPAC
- ethyl 2-(triazol-1-yl)acetate
- English name
- 1H-1,2,3-TRIAZOLE-1-ACETIC ACID ETHYL ESTER
- Molecular formula
- C6H9N3O2
- Molecular weight
- 155.15
Names & synonyms
4314-21-0ETHYL 2-(1H-1,2,3-TRIAZOL-1-YL)ACETATEEthyl 2-(triazol-1-yl)acetate1H-1,2,3-triazole-1-acetic acid ethyl ester1H-1,2,3-Triazole-1-acetic aicd ethyl esterSCHEMBL314952SCHEMBL4906256SCHEMBL15474980DTXSID20435572DAWFJGMMMBJQBB-UHFFFAOYSA-NEAA31421MFCD03840807
Show more names
AKOS006277574AB16642DA-05893Ethyl (1H-1,2,3-triazol-1-yl)acetate1H-1,2,3-Triazole-1-aceticacidethylesterCS-0109809[1,2,3]triazol-1-yl-acetic acid ethyl esterD76937
Database identifiers
- CAS
4314-21-0- PubChem CID
- 10103365
- DTXSID
DTXSID20435572- EC Number
- 192-200-0
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- White to off-white Solid
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
12 records
Compound notes
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