Basic information
- CAS
116005-04-0- Standard SMILES
CCCN(CCC)C1COc2ccc(O)cc2C1- InChIKey
COYBCQFIVNQGKW-UHFFFAOYSA-N- Molecular formula
- C15H23NO2
- Average molar mass
- 249.35 g/mol
- Monoisotopic mass
- 249.17287898
Overview
RN & structure given in first source
Names & identifiers
- Preferred name
- 6-hydroxy-3,4-dihydro-3-(dipropylamino)-2H-1-benzopyran
- IUPAC
- 3-(dipropylamino)-3,4-dihydro-2H-chromen-6-ol
- English name
- 6-hydroxy-3,4-dihydro-3-(dipropylamino)-2H-1-benzopyran
- Molecular formula
- C15H23NO2
- Molecular weight
- 249.35
Names & synonyms
6-Hddpb116005-04-0DP-6OH-3CADipropyl-6-hydroxy-3-chromanamine6-Hydroxy-3,4-dihydro-3-(dipropylamino)-2H-1-benzopyranRefChem:9139563-(Dipropylamino)-3,4-dihydro-2H-1-benzopyran-6-olCHEMBL694143-Dipropylamino-chroman-6-olDTXSID90874737BDBM500105872H-1-Benzopyran-6-ol, 3-(dipropylamino)-3,4-dihydro-
Show more names
2H-1-BENZOPYRAN-6-OL, 3-(DIPROPYLAMINO)-3,4-DIHY
Database identifiers
- CAS
116005-04-0- PubChem CID
- 86146
- DTXSID
DTXSID90874737- ChEMBL
CHEMBL69414- Nikkaji
- J668.370C
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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