1,3-Propanediol, 2-methyl-2-((2-phenanthrenylmethyl)amino)-, hydrochloride
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Basic information
- CAS
96404-35-2- Standard SMILES
CC(CO)(CO)NCc1ccc2c(ccc3ccccc32)c1.Cl- InChIKey
JYNLWFGRWAZROB-UHFFFAOYSA-N- Molecular formula
- C19H22ClNO2
- Average molar mass
- 331.8 g/mol
- Monoisotopic mass
- 331.1339066
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-methyl-2-((2-phenanthrenylmethyl)amino)-, hydrochloride
- IUPAC
- 2-methyl-2-(phenanthren-2-ylmethylamino)propane-1,3-diol;hydrochloride
- English name
- 1,3-Propanediol, 2-methyl-2-((2-phenanthrenylmethyl)amino)-, hydrochlo ride
- Molecular formula
- C19H21NO2*ClH
- Molecular weight
- 0
Names & synonyms
1,3-Propanediol, 2-methyl-2-((2-phenanthrenylmethyl)amino)-, hydrochloride96404-35-2DTXSID702422382-Methyl-2-((2-phenanthrenylmethyl)amino)-1,3-propanediol hydrochlorideRefChem:219678DTXCID70164729CHEMBL555650SCHEMBL105497722-Methyl-2-{[(phenanthren-2-yl)methyl]amino}propane-1,3-diol--hydrogen chloride (1/1)1,3-Propanediol, 2-methyl-2-((2-phenanthrenylmethyl)amino)-, hydrochlo ride
Database identifiers
- CAS
96404-35-2- PubChem CID
- 150419
- DTXSID
DTXSID70242238- ChEMBL
CHEMBL555650
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 355
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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