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88778-86-3 | Naphth[2,1-d]oxazol-5-ol, 2-pentadecyl-
CAS No: 88778-86-3 Catalog No: AG004B27 MDL No:
Product Description
Catalog Number:
AG004B27
Chemical Name:
Naphth[2,1-d]oxazol-5-ol, 2-pentadecyl-
CAS Number:
88778-86-3
Molecular Formula:
C26H37NO2
Molecular Weight:
395.5775
IUPAC Name:
2-pentadecylbenzo[g][1,3]benzoxazol-5-ol
InChI:
InChI=1S/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-25-27-23-20-24(28)21-17-15-16-18-22(21)26(23)29-25/h15-18,20,28H,2-14,19H2,1H3
InChI Key:
OCOZOSLTIDLVOS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCc1nc2c(o1)c1ccccc1c(c2)O
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.282g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
395.587g/mol
Monoisotopic Mass:
395.282g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.3
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