Basic information
- CAS
133550-83-1- Standard SMILES
CC(CO)(CO)NCc1ccc(-c2ccccc2)c2ccccc12.Cl- InChIKey
OGIWOCWHNYHCTA-UHFFFAOYSA-N- Molecular formula
- C21H24ClNO2
- Average molar mass
- 357.9 g/mol
- Monoisotopic mass
- 357.1495567
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-methyl-2-(((4-phenyl-1-naphthalenyl)methyl)amino)-, hydrochloride
- IUPAC
- 2-methyl-2-[(4-phenylnaphthalen-1-yl)methylamino]propane-1,3-diol;hydrochloride
- English name
- 2-methyl-2-[(4-phenylnaphthalen-1-yl)methylamino]propane-1,3-diol hydr ochloride
- Molecular formula
- C21H24ClNO2
- Molecular weight
- 0
Names & synonyms
133550-83-11,3-Propanediol, 2-methyl-2-(((4-phenyl-1-naphthalenyl)methyl)amino)-, hydrochloride2-Methyl-2-(((4-phenyl-1-naphthalenyl)methyl)amino)-1,3-propanediol hydrochlorideDTXSID00158171RefChem:219669DTXCID0080662CHEMBL5449822-methyl-2-[(4-phenylnaphthalen-1-yl)methylamino]propane-1,3-diol;hydrochloride2-Methyl-2-{[(4-phenylnaphthalen-1-yl)methyl]amino}propane-1,3-diol--hydrogen chloride (1/1)2-methyl-2-[(4-phenylnaphthalen-1-yl)methylamino]propane-1,3-diol hydr ochloride
Database identifiers
- CAS
133550-83-1- PubChem CID
- 149658
- DTXSID
DTXSID00158171- ChEMBL
CHEMBL544982
Properties
Computed structural properties
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 376
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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