Basic information
- CAS
63869-95-4- Standard SMILES
CC[NH+](CC)CCCC(=O)OC.[Br-]- InChIKey
GRRJOIIJBGENPL-UHFFFAOYSA-N- Molecular formula
- C9H20BrNO2
- Average molar mass
- 254.16 g/mol
- Monoisotopic mass
- 253.06774
Names & identifiers
- Preferred name
- Methyl 4-(diethylamino)butanoate--hydrogen bromide (1/1)
- IUPAC
- diethyl-(4-methoxy-4-oxobutyl)azanium bromide
Names & synonyms
63869-95-4DTXSID40980635Methyl 4-(diethylamino)butanoate--hydrogen bromide (1/1)RefChem:1089450DTXCID501407909Methyl-gamma-diethylaminobutyrate hydrobromideDF 666BUTYRIC ACID, 4-(DIETHYLAMINO)-, METHYL ESTER, HYDROBROMIDE
Database identifiers
- CAS
63869-95-4- PubChem CID
- 44909
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 122
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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