3-(Diethylamino)propyl 9,10-dihydroanthracene-9-carboxylate--hydrogen chloride (1/1)
Basic information
- CAS
66827-81-4- Standard SMILES
CC[NH+](CC)CCCOC(=O)C1c2ccccc2Cc2ccccc21.[Cl-]- InChIKey
NODVCAUSFKGTJA-UHFFFAOYSA-N- Molecular formula
- C22H28ClNO2
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1808568
Names & identifiers
- Preferred name
- 3-(Diethylamino)propyl 9,10-dihydroanthracene-9-carboxylate--hydrogen chloride (1/1)
- IUPAC
- 3-(9,10-dihydroanthracene-9-carbonyloxy)propyl-diethylazanium chloride
Names & synonyms
66827-81-4DTXSID209854213-(Diethylamino)propyl 9,10-dihydroanthracene-9-carboxylate--hydrogen chloride (1/1)RefChem:1067069DTXCID1014126159,10-Dihydro-9-anthroic acid 3-(diethylamino)propyl ester hydrochloride9-ANTHROIC ACID, 9,10-DIHYDRO-, 3-(DIETHYLAMINO)PROPYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
66827-81-4- PubChem CID
- 48117
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 398
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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