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2-(14-carboxytetradecyl)-2-ethyl-4,4-dimethyl-1,3-oxazolidin-3-yloxidanyl

2-(14-carboxytetradecyl)-2-ethyl-4,4-dimethyl-1,3-oxazolidin-3-yloxidanyl

CAS: 53034-38-1

Formula: C22H42NO4

SMILES: CCC1(CCCCCCCCCCCCCCC(O)=O)OCC(C)(C)N1[O]

IUPAC: [2-(14-carboxytetradecyl)-2-ethyl-4,4-dimethyl-1,3-oxazolidin-3-yl]oxidanyl

InChI: InChI=1/C22H42NO4/c1-4-22(23(26)21(2,3)19-27-22)18-16-14-12-10-8-6-5-7-9-11-13-15-17-20(24)25/h4-19H2,1-3H3,(H,24,25)

Composition: C (68.71%), H (11.01%), N (3.64%), O (16.64%)

Molar Mass: 384.581

Atom Count: 69

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 384.311383836
Formal Charge 0
FSP3 0.95
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey RPAZYIOIDZRJOO-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 108.56
Topological Polar Surface Area 49.77
Polarizability 43.44
Ring Count 1
Rotatable Bond Count 16

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