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34331-80-1 | Oxazole,2-heptadecyl-4,5-dihydro-4,4-dimethyl-
CAS No: 34331-80-1 Catalog No: AG007G6B MDL No:
Product Description
Catalog Number:
AG007G6B
Chemical Name:
Oxazole,2-heptadecyl-4,5-dihydro-4,4-dimethyl-
CAS Number:
34331-80-1
Molecular Formula:
C22H43NO
Molecular Weight:
337.5829
IUPAC Name:
2-heptadecyl-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C22H43NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-22(2,3)20-24-21/h4-20H2,1-3H3
InChI Key:
NVSOSXIRJQBCAP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC1=NC(CO1)(C)C
NSC Number:
17728
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.334g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.592g/mol
Monoisotopic Mass:
337.334g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
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