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188656-76-0 | 1-Naphthalenol, 2,2'-[2-(phenylmethoxy)ethylidene]bis[4,8-dimethoxy-
CAS No: 188656-76-0 Catalog No: AG002H41 MDL No:
Product Description
Catalog Number:
AG002H41
Chemical Name:
1-Naphthalenol, 2,2'-[2-(phenylmethoxy)ethylidene]bis[4,8-dimethoxy-
CAS Number:
188656-76-0
Molecular Formula:
C33H32O7
Molecular Weight:
540.6030
IUPAC Name:
2-[1-(1-hydroxy-4,8-dimethoxynaphthalen-2-yl)-2-phenylmethoxyethyl]-4,8-dimethoxynaphthalen-1-ol
InChI:
InChI=1S/C33H32O7/c1-36-26-14-8-12-21-28(38-3)16-23(32(34)30(21)26)25(19-40-18-20-10-6-5-7-11-20)24-17-29(39-4)22-13-9-15-27(37-2)31(22)33(24)35/h5-17,25,34-35H,18-19H2,1-4H3
InChI Key:
UJLRXEZKHQUYDX-UHFFFAOYSA-N
SMILES:
COc1cccc2c1c(O)c(cc2OC)C(c1cc(OC)c2c(c1O)c(OC)ccc2)COCc1ccccc1
Properties
Complexity:
709
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
540.215g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
540.612g/mol
Monoisotopic Mass:
540.215g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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