1,3-Propanediol, 2-methyl-2-((1-triphenylenylmethyl)amino)-, hydrochloride
Basic information
- CAS
133550-89-7- Standard SMILES
CC(CO)(CO)NCc1cccc2c3ccccc3c3ccccc3c12.Cl- InChIKey
ULZZRYBIJZTGIA-UHFFFAOYSA-N- Molecular formula
- C23H24ClNO2
- Average molar mass
- 381.9 g/mol
- Monoisotopic mass
- 381.1495567
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-methyl-2-((1-triphenylenylmethyl)amino)-, hydrochloride
- IUPAC
- 2-methyl-2-(triphenylen-1-ylmethylamino)propane-1,3-diol;hydrochloride
Names & synonyms
1,3-Propanediol, 2-methyl-2-((1-triphenylenylmethyl)amino)-, hydrochloride2-Methyl-2-((1-triphenylenylmethyl)amino)-1,3-propanediol hydrochloride133550-89-7DTXSID60158177RefChem:219675DTXCID0080668CHEMBL538739SCHEMBL94660852-Methyl-2-{[(triphenylen-1-yl)methyl]amino}propane-1,3-diol--hydrogen chloride (1/1)
Database identifiers
- CAS
133550-89-7- PubChem CID
- 197294
- DTXSID
DTXSID60158177- ChEMBL
CHEMBL538739
Properties
Computed structural properties
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 463
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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