4-Methyl-6-(1-methylethyl)-3-(1-methylpropyl)-2,5-morpholinedione

HCID 558283

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Basic information

CAS: 2503-14-2
Standard SMILES: CCC(C)C1C(=O)OC(C(C)C)C(=O)N1C
InChIKey: ONIMTCSWGFMARW-UHFFFAOYSA-N
Molecular formula: C12H21NO3
Average molar mass: 227.3 g/mol
Monoisotopic mass: 227.15214353

Names & identifiers

Preferred name: 4-Methyl-6-(1-methylethyl)-3-(1-methylpropyl)-2,5-morpholinedione
IUPAC: 3-butan-2-yl-4-methyl-6-propan-2-ylmorpholine-2,5-dione

Names & synonyms

2503-14-24-Methyl-6-(1-methylethyl)-3-(1-methylpropyl)-2,5-morpholinedioneRefChem:2943953-(2-Butyl)-6-isopropyl-4-methyl-2,5-dioxomorpholineONIMTCSWGFMARW-UHFFFAOYSA-NDTXSID5011693593-Sec-butyl-6-isopropyl-4-methyl-2,5-morpholinedione #3-(Butan-2-yl)-4-methyl-6-(propan-2-yl)morpholine-2,5-dione3-(butan-2-yl)-6-(propan-2-yl)-4-methyl-morpholine-2,5-dione

Database identifiers

CAS: 2503-14-2
PubChem CID: 558283
DTXSID: DTXSID501169359

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 46.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 288

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