1,3-Propanediol, 2-methyl-2-((1-naphthalenylmethyl)amino)-, hydrochloride
Basic information
- CAS
133550-78-4- Standard SMILES
CC(CO)(CO)NCc1cccc2ccccc12.Cl- InChIKey
ZFIFWHSWNZUYDY-UHFFFAOYSA-N- Molecular formula
- C15H20ClNO2
- Average molar mass
- 281.78 g/mol
- Monoisotopic mass
- 281.1182566
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-methyl-2-((1-naphthalenylmethyl)amino)-, hydrochloride
- IUPAC
- 2-methyl-2-(naphthalen-1-ylmethylamino)propane-1,3-diol;hydrochloride
Names & synonyms
1,3-Propanediol, 2-methyl-2-((1-naphthalenylmethyl)amino)-, hydrochloride2-Methyl-2-((1-naphthalenylmethyl)amino)-1,3-propanediol hydrochloride133550-78-4DTXSID50158166RefChem:219671DTXCID1080657CHEMBL5447542-Methyl-2-{[(naphthalen-1-yl)methyl]amino}propane-1,3-diol--hydrogen chloride (1/1)
Database identifiers
- CAS
133550-78-4- PubChem CID
- 197288
- DTXSID
DTXSID50158166- ChEMBL
CHEMBL544754
Properties
Computed structural properties
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 253
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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