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921758-52-3 | Methanone, (2-chlorophenyl)[4-(hexyloxy)-1-hydroxy-2-naphthalenyl]-
CAS No: 921758-52-3 Catalog No: AG006GPN MDL No:
Product Description
Catalog Number:
AG006GPN
Chemical Name:
Methanone, (2-chlorophenyl)[4-(hexyloxy)-1-hydroxy-2-naphthalenyl]-
CAS Number:
921758-52-3
Molecular Formula:
C23H23ClO3
Molecular Weight:
382.8799
IUPAC Name:
(2-chlorophenyl)-(4-hexoxy-1-hydroxynaphthalen-2-yl)methanone
InChI:
InChI=1S/C23H23ClO3/c1-2-3-4-9-14-27-21-15-19(22(25)17-11-6-5-10-16(17)21)23(26)18-12-7-8-13-20(18)24/h5-8,10-13,15,25H,2-4,9,14H2,1H3
InChI Key:
WJAINVYWOJUYHY-UHFFFAOYSA-N
SMILES:
CCCCCCOc1cc(C(=O)c2ccccc2Cl)c(c2c1cccc2)O
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.134g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
382.884g/mol
Monoisotopic Mass:
382.134g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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