Hexyl hydrogen (2-hydroxyethyl)carbonimidate
Basic information
- CAS
6948-32-9- Standard SMILES
CCCCCCOC(=O)NCCO- InChIKey
IKJCCTFEPQFEPT-UHFFFAOYSA-N- Molecular formula
- C9H19NO3
- Average molar mass
- 189.25 g/mol
- Monoisotopic mass
- 189.13649347
Names & identifiers
- Preferred name
- Hexyl hydrogen (2-hydroxyethyl)carbonimidate
- IUPAC
- hexyl N-(2-hydroxyethyl)carbamate
Names & synonyms
6948-32-9NSC55759Hexyl hydrogen (2-hydroxyethyl)carbonimidateSCHEMBL9740500DTXSID80989425NSC-55759
Database identifiers
- CAS
6948-32-9- PubChem CID
- 244668
- DTXSID
DTXSID80989425
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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