Basic information
- CAS
1630763-57-3- Standard SMILES
COCc1nc(C(N)c2ccccc2)n[nH]1.Cl- InChIKey
RYJOVCPPKGYEJT-UHFFFAOYSA-N- Molecular formula
- C11H15ClN4O
- Average molar mass
- 254.71 g/mol
- Monoisotopic mass
- 254.0934388
Names & identifiers
- Preferred name
- (5-(methoxymethyl)-1H-1,2,4-triazol-3-yl)(phenyl)methanamine hydrochloride
- IUPAC
- [5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]-phenylmethanamine;hydrochloride
Names & synonyms
(5-(methoxymethyl)-1H-1,2,4-triazol-3-yl)(phenyl)methanamine hydrochloride1630763-57-3[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]-phenylmethanamine;hydrochlorideAKOS030504901
Database identifiers
- CAS
1630763-57-3- PubChem CID
- 91640314
Properties
Computed structural properties
- Topological polar surface area
- 76.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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