tert-Butyl (3-methyl-4H-1,2,4-triazol-4-yl)carbamate
Basic information
- CAS
209797-71-7- Standard SMILES
Cc1nncn1NC(=O)OC(C)(C)C- InChIKey
ZBZZAMAGHVYRJV-UHFFFAOYSA-N- Molecular formula
- C8H14N4O2
- Average molar mass
- 198.22 g/mol
Names & identifiers
- Preferred name
- tert-Butyl (3-methyl-4H-1,2,4-triazol-4-yl)carbamate
- IUPAC
- tert-butyl N-(3-methyl-1,2,4-triazol-4-yl)carbamate
- English name
- Carbamic acid, (3-methyl-4H-1,2,4-triazol-4-yl)-, 1,1-dimethylethyl ester (9CI)
- Molecular formula
- C8H14N4O2
- Molecular weight
- 198.22
Names & synonyms
209797-71-7tert-Butyl (3-methyl-4H-1,2,4-triazol-4-yl)carbamateNSC710437NSC-710437Carbamic acid, (3-methyl-4H-1,2,4-triazol-4-yl)-, 1,1-dimethylethyl ester (9CI)
Database identifiers
- CAS
209797-71-7- Nikkaji
- J956.917K
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 69 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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