Basic information
- CAS
63981-83-9- Standard SMILES
C[N+](C)(C)CCCCOC(N)=O.[Cl-]- InChIKey
DSYBKRUBFHBULI-UHFFFAOYSA-N- Molecular formula
- C8H19ClN2O2
- Average molar mass
- 210.7 g/mol
- Monoisotopic mass
- 210.1135055
Names & identifiers
- Preferred name
- Ammonium, (4-hydroxybutyl)trimethyl-, chloride, carbamate
- IUPAC
- 4-carbamoyloxybutyl(trimethyl)azanium chloride
Names & synonyms
Carbamic acid, 4-(trimethylammonio)butyl ester, chloride63981-83-9Ammonium, (4-(carbamoyloxy)butyl)trimethyl-, chlorideCarbamic acid, 4-dimethylaminobutyl ester, methochloride1-Butanaminium, 4-(aminocarbonyl)oxy-N,N,N-trimethyl-, chlorideAMMONIUM, (4-HYDROXYBUTYL)TRIMETHYL-, CHLORIDE, CARBAMATERefChem:318932
Database identifiers
- CAS
63981-83-9- PubChem CID
- 46015
Properties
Computed structural properties
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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