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2,4-Oxazolidinedione, 5,5-dipropyl-

HCID 79876
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Basic information

CAS
512-12-9
Standard SMILES
CCCC1(CCC)OC(=O)NC1=O
InChIKey
BVTOXVHDKWVNBF-UHFFFAOYSA-N
Molecular formula
C9H15NO3
Average molar mass
185.22 g/mol
Monoisotopic mass
185.10519334

Names & identifiers

Preferred name
2,4-Oxazolidinedione, 5,5-dipropyl-
IUPAC
5,5-dipropyl-1,3-oxazolidine-2,4-dione

Names & synonyms

2,4-Oxazolidinedione, 5,5-dipropyl-512-12-95,5-Dipropyl-2,4-oxazolidinedione5,5-Dipropyl-2,4-oxazolidinedione [MI]3Q181RIU8E5,5-dipropyl-1,3-oxazolidine-2,4-dioneUNII-3Q181RIU8EDipropyl-oxazolidin-dionSCHEMBL3498871DTXSID20275778Q27257887

Database identifiers

CAS
512-12-9
PubChem CID
79876
DTXSID
DTXSID20275778
UNII
3Q181RIU8E
Nikkaji
J182.556I

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
13
Formal charge
0
Complexity
219

Related reactions

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Compound notes

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