2-Propanol, 1-(3-methoxypropyl)amino-3-phenoxy-
Basic information
- CAS
7614-41-7- Standard SMILES
COCCCNCC(O)COc1ccccc1.Cl- InChIKey
LVHPZBQZUDBDIN-UHFFFAOYSA-N- Molecular formula
- C13H22ClNO3
- Average molar mass
- 275.77 g/mol
- Monoisotopic mass
- 275.1288213
Names & identifiers
- Preferred name
- 2-Propanol, 1-(3-methoxypropyl)amino-3-phenoxy-
- IUPAC
- 1-(3-methoxypropylamino)-3-phenoxypropan-2-ol;hydrochloride
Names & synonyms
SAS 5012-Propanol, 1-(3-methoxypropyl)amino-3-phenoxy-7614-41-7RefChem:265738DTXSID609974871-[(3-Methoxypropyl)amino]-3-phenoxypropan-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
7614-41-7- PubChem CID
- 202167
- DTXSID
DTXSID60997487
Properties
Computed structural properties
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…