Dodecanoic acid, compd. with 1-((1-methylethyl)amino)-3-(1-naphthalenyloxy)-2-propanol (1:1)
Basic information
- CAS
138656-55-0- Standard SMILES
CC(C)NCC(O)COc1cccc2ccccc12.CCCCCCCCCCCC(=O)O- InChIKey
CAWRJDLZCQEKMX-UHFFFAOYSA-N- Molecular formula
- C28H45NO4
- Average molar mass
- 459.7 g/mol
- Monoisotopic mass
- 459.33485892
Names & identifiers
- Preferred name
- Dodecanoic acid, compd. with 1-((1-methylethyl)amino)-3-(1-naphthalenyloxy)-2-propanol (1:1)
- IUPAC
- dodecanoic acid;1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
- English name
- propranolol laurate
- Molecular weight
- 0
Names & synonyms
Propranolol laurate138656-55-0Propranolol dodecanoateKY69W91A2FRefChem:176459UNII-KY69W91A2FSCHEMBL7770896DTXSID20930178PROPRANOLOL LAURATE, (+/-)-Q272824932-PROPANOL, 1-((1-METHYLETHYL)AMINO)-3-(1-NAPHTHALENYLOXY)-, DODECANOATE (SALT)Dodecanoic acid--1-[(naphthalen-1-yl)oxy]-3-[(propan-2-yl)amino]propan-2-ol (1/1)
Database identifiers
- CAS
138656-55-0- PubChem CID
- 3036087
- DTXSID
DTXSID20930178- UNII
- KY69W91A2F
Properties
Computed structural properties
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 16
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- FDA UNII
- 69 W91A2F · KY69W91A2F
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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