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89475-11-6 | Naphthalene, 5-chloro-1,4-dimethoxy-2-methyl-8-(phenylmethoxy)-
CAS No: 89475-11-6 Catalog No: AG00423L MDL No:
Product Description
Catalog Number:
AG00423L
Chemical Name:
Naphthalene, 5-chloro-1,4-dimethoxy-2-methyl-8-(phenylmethoxy)-
CAS Number:
89475-11-6
Molecular Formula:
C20H19ClO3
Molecular Weight:
342.8161
IUPAC Name:
5-chloro-1,4-dimethoxy-2-methyl-8-phenylmethoxynaphthalene
InChI:
InChI=1S/C20H19ClO3/c1-13-11-17(22-2)18-15(21)9-10-16(19(18)20(13)23-3)24-12-14-7-5-4-6-8-14/h4-11H,12H2,1-3H3
InChI Key:
HFAOBEZQXNCBLN-UHFFFAOYSA-N
SMILES:
COc1c(C)cc(c2c1c(OCc1ccccc1)ccc2Cl)OC
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.102g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.819g/mol
Monoisotopic Mass:
342.102g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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