Basic information
- CAS
25384-42-3- Standard SMILES
CCCC(C)(CO)COC(=O)N1CCOCC1- InChIKey
JDRCJFGWTFMWAJ-UHFFFAOYSA-N- Molecular formula
- C12H23NO4
- Average molar mass
- 245.32 g/mol
- Monoisotopic mass
- 245.16270821
Names & identifiers
- Preferred name
- 4-Morpholinecarboxylic acid, 2-(hydroxymethyl)-2-methylpentyl ester
- IUPAC
- [2-(hydroxymethyl)-2-methylpentyl] morpholine-4-carboxylate
Names & synonyms
25384-42-34-Morpholinecarboxylic acid, 2-(hydroxymethyl)-2-methylpentyl esterRefChem:1071243BRN 15746582-(Hydroxymethyl)-2-methylpentyl-4-morpholinecarboxylate2-(hydroxymethyl)-2-methylpentyl morpholine-4-carboxylateDTXSID70948228
Database identifiers
- CAS
25384-42-3- PubChem CID
- 212905
- DTXSID
DTXSID70948228
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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