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88229-67-8 | 2-Oxazoledodecanol, 4,5-dihydro-5,5-dimethyl-
CAS No: 88229-67-8 Catalog No: AG004B7D MDL No:
Product Description
Catalog Number:
AG004B7D
Chemical Name:
2-Oxazoledodecanol, 4,5-dihydro-5,5-dimethyl-
CAS Number:
88229-67-8
Molecular Formula:
C17H33NO2
Molecular Weight:
283.4494
IUPAC Name:
12-(5,5-dimethyl-4H-1,3-oxazol-2-yl)dodecan-1-ol
InChI:
InChI=1S/C17H33NO2/c1-17(2)15-18-16(20-17)13-11-9-7-5-3-4-6-8-10-12-14-19/h19H,3-15H2,1-2H3
InChI Key:
UNQJKUSFGROKDE-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCCC1=NCC(O1)(C)C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.251g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.456g/mol
Monoisotopic Mass:
283.251g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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