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128751-66-6 | 2-Oxazolidinone, 4-(hydroxymethyl)-5-(1E)-1-pentadecen-1-yl-, (4S,5R)-
CAS No: 128751-66-6 Catalog No: AG000YCZ MDL No:
Product Description
Catalog Number:
AG000YCZ
Chemical Name:
2-Oxazolidinone, 4-(hydroxymethyl)-5-(1E)-1-pentadecen-1-yl-, (4S,5R)-
CAS Number:
128751-66-6
Molecular Formula:
C19H35NO3
Molecular Weight:
325.4861
IUPAC Name:
(4S,5R)-4-(hydroxymethyl)-5-pentadec-1-enyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C19H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-17(16-21)20-19(22)23-18/h14-15,17-18,21H,2-13,16H2,1H3,(H,20,22)/t17-,18+/m0/s1
InChI Key:
DZBJFRVUBYQXAF-ZWKOTPCHSA-N
SMILES:
CCCCCCCCCCCCC/C=C/[C@H]1OC(=O)N[C@H]1CO
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
325.262g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
325.493g/mol
Monoisotopic Mass:
325.262g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.4
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