Basic information
- CAS
96404-62-5- Standard SMILES
CC(CO)(CO)NCc1cccc2cc3ccccc3cc12.Cl- InChIKey
QHXJQBSQQVLNEQ-UHFFFAOYSA-N- Molecular formula
- C19H22ClNO2
- Average molar mass
- 331.8 g/mol
- Monoisotopic mass
- 331.1339066
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-((1-anthracenylmethyl)amino)-2-methyl-, hydrochloride
- IUPAC
- 2-(anthracen-1-ylmethylamino)-2-methylpropane-1,3-diol;hydrochloride
- English name
- 1,3-Propanediol, 2-((1-anthracenylmethyl)amino)-2-methyl-, hydrochlori de
- Molecular formula
- C19H21NO2*ClH
- Molecular weight
- 0
Names & synonyms
1,3-Propanediol, 2-((1-anthracenylmethyl)amino)-2-methyl-, hydrochloride2-((1-Anthracenylmethyl)amino)-2-methyl-1,3-propanediol hydrochloride96404-62-5DTXSID00242241RefChem:219559DTXCID00164732CHEMBL545443SCHEMBL104882042-{[(Anthracen-1-yl)methyl]amino}-2-methylpropane-1,3-diol--hydrogen chloride (1/1)1,3-Propanediol, 2-((1-anthracenylmethyl)amino)-2-methyl-, hydrochlori de
Database identifiers
- CAS
96404-62-5- PubChem CID
- 150421
- DTXSID
DTXSID00242241- ChEMBL
CHEMBL545443
Properties
Computed structural properties
- 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
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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