Propyl hydrogen (2-hydroxyethyl)carbonimidate
Basic information
- CAS
6948-23-8- Standard SMILES
CCCOC(=O)NCCO- InChIKey
QACFTHQWWFYKBZ-UHFFFAOYSA-N- Molecular formula
- C6H13NO3
- Average molar mass
- 147.17 g/mol
- Monoisotopic mass
- 147.08954328
Names & identifiers
- Preferred name
- Propyl hydrogen (2-hydroxyethyl)carbonimidate
- IUPAC
- propyl N-(2-hydroxyethyl)carbamate
Names & synonyms
6948-23-8NSC55745SCHEMBL606637SCHEMBL606638SCHEMBL1416145SCHEMBL1416147DTXSID20989424NSC-55745AKOS006356707Propyl hydrogen (2-hydroxyethyl)carbonimidate
Database identifiers
- CAS
6948-23-8- PubChem CID
- 244658
- DTXSID
DTXSID20989424- Nikkaji
- J1.485.672B
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 95
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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