2-Amino-1-(2-methoxy-5-methylphenyl)propan-1-ol
Basic information
- CAS
791739-17-8- Standard SMILES
COc1ccc(C)cc1C(O)C(C)N- InChIKey
TZOQRNSNVWMTCO-UHFFFAOYSA-N- Molecular formula
- C11H17NO2
- Average molar mass
- 195.26 g/mol
- Monoisotopic mass
- 195.12592878
Names & identifiers
- Preferred name
- 2-Amino-1-(2-methoxy-5-methylphenyl)propan-1-ol
- IUPAC
- 2-amino-1-(2-methoxy-5-methylphenyl)propan-1-ol
- English name
- Benzenemethanol, alpha-(1-aminoethyl)-2-methoxy-5-methyl- (9CI)
- Molecular formula
- C11H17NO2
- Molecular weight
- 195.25818
Names & synonyms
791739-17-82-amino-1-(2-methoxy-5-methylphenyl)propan-1-olSCHEMBL5051458DTXSID20275617AKOS022258269AG-H-17635Benzenemethanol, alpha-(1-aminoethyl)-2-methoxy-5-methyl- (9CI)
Database identifiers
- CAS
791739-17-8- PubChem CID
- 56333
- DTXSID
DTXSID20275617
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 55.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Physicochemical properties
- Comptox DTXSID
- 20275617 · DTXSID20275617
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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