1,3-Propanediol, 2-methyl-2-propyl-, carbamate, N,N-oxydiethylenecarbamate
Basic information
- CAS
25642-81-3- Standard SMILES
CCCC(C)(COC(N)=O)COC(=O)N1CCOCC1- InChIKey
CUBBLXVBSIQEFT-UHFFFAOYSA-N- Molecular formula
- C13H24N2O5
- Average molar mass
- 288.34 g/mol
- Monoisotopic mass
- 288.16852187
Names & identifiers
- Preferred name
- 1,3-Propanediol, 2-methyl-2-propyl-, carbamate, N,N-oxydiethylenecarbamate
- IUPAC
- [2-(carbamoyloxymethyl)-2-methylpentyl] morpholine-4-carboxylate
- English name
- 4-Morpholinecarboxylic acid 2-(carbamoyloxymethyl)-2-methylpentyl ester
- Molecular formula
- C13H24N2O5
- Molecular weight
- 288.34
Names & synonyms
BRN 158340725642-81-32-Methyl-2-propyl-1,3-propanediol carbamate oxydiethylcarbamate1,3-Propanediol, 2-methyl-2-propyl-, carbamate, N,N-oxydiethylenecarbamateRefChem:219702DTXSID809485122-{[Hydroxy(imino)methoxy]methyl}-2-methylpentyl morpholine-4-carboxylate4-Morpholinecarboxylic acid 2-(carbamoyloxymethyl)-2-methylpentyl ester4-Morpholinecarboxylic acid, 2-[[(aminocarbonyl)oxy]methyl]-2-methylpentyl ester
Database identifiers
- CAS
25642-81-3- PubChem CID
- 117264
- DTXSID
DTXSID80948512- Nikkaji
- J50.887J
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 91.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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