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96964-41-9 | Oxazole, 2-(2-dodecylphenyl)-4,5-dihydro-4,4-dimethyl-
CAS No: 96964-41-9 Catalog No: AG005SGO MDL No:
Product Description
Catalog Number:
AG005SGO
Chemical Name:
Oxazole, 2-(2-dodecylphenyl)-4,5-dihydro-4,4-dimethyl-
CAS Number:
96964-41-9
Molecular Formula:
C23H37NO
Molecular Weight:
343.5460
IUPAC Name:
2-(2-dodecylphenyl)-4,4-dimethyl-5H-1,3-oxazole
InChI:
InChI=1S/C23H37NO/c1-4-5-6-7-8-9-10-11-12-13-16-20-17-14-15-18-21(20)22-24-23(2,3)19-25-22/h14-15,17-18H,4-13,16,19H2,1-3H3
InChI Key:
MSVILKWLCBBYFL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccccc1C1=NC(CO1)(C)C
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.288g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.555g/mol
Monoisotopic Mass:
343.288g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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