Benzyl alcohol, alpha-(2-(dimethylamino)-1-phenoxyethyl)-, hydrochloride
Basic information
- CAS
5331-85-1- Standard SMILES
C[NH+](C)CC(Oc1ccccc1)C(O)c1ccccc1.[Cl-]- InChIKey
AAPGKZFKHTZMTB-UHFFFAOYSA-N- Molecular formula
- C17H22ClNO2
- Average molar mass
- 307.8 g/mol
- Monoisotopic mass
- 307.1339066
Names & identifiers
- Preferred name
- Benzyl alcohol, alpha-(2-(dimethylamino)-1-phenoxyethyl)-, hydrochloride
- IUPAC
- (3-hydroxy-2-phenoxy-3-phenylpropyl)-dimethylazanium chloride
Names & synonyms
SL68GQ2VQKBENZYL ALCOHOL, alpha-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE5331-85-1NSC-2334RefChem:1079443NSC 2334U-0177UNII-SL68GQ2VQKalpha-(2-(Dimethylamino)-1-phenoxyethyl)benzyl alcohol hydrochlorideBENZENEMETHANOL, .ALPHA.-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDEBENZENEMETHANOL, .ALPHA.-(2-(DIMETHYLAMINO)-1-PHENOXYETHYL)-, HYDROCHLORIDE (1:1)
Database identifiers
- CAS
5331-85-1- PubChem CID
- 21409
- UNII
- SL68GQ2VQK
Properties
Computed structural properties
- Topological polar surface area
- 33.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 258
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…