Basic information
- CAS
14056-65-6- Standard SMILES
C#CC(OC(N)=O)C(C)C- InChIKey
LMIOSZBCJOOCPZ-UHFFFAOYSA-N- Molecular formula
- C7H11NO2
- Average molar mass
- 141.17 g/mol
- Monoisotopic mass
- 141.07897859
Names & identifiers
- Preferred name
- 4-Methylpent-1-yn-3-yl hydrogen carbonimidate
- IUPAC
- 4-methylpent-1-yn-3-yl carbamate
Names & synonyms
14056-65-6DTXSID209308754-Methylpent-1-yn-3-yl hydrogen carbonimidateRefChem:1071179DTXCID901359596BRN 1758710Carbamic acid, 1-isopropyl-2-propynyl ester1-Pentyn-3-ol, 4-methyl-, carbamateCarbammato di 2-methyl-delta 4,5-pentin-2-olo [Italian]Carbammato di 2-methyl-delta 4,5-pentin-2-oloAKOS006364648
Database identifiers
- CAS
14056-65-6- PubChem CID
- 203243
- DTXSID
DTXSID20930875
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…