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251452-47-8 | Anthracene, 9,10-bis[(2-ethylhexyl)oxy]-
CAS No: 251452-47-8 Catalog No: AG002QME MDL No:
Product Description
Catalog Number:
AG002QME
Chemical Name:
Anthracene, 9,10-bis[(2-ethylhexyl)oxy]-
CAS Number:
251452-47-8
Molecular Formula:
C30H42O2
Molecular Weight:
434.6533
IUPAC Name:
9,10-bis(2-ethylhexoxy)anthracene
InChI:
InChI=1S/C30H42O2/c1-5-9-15-23(7-3)21-31-29-25-17-11-13-19-27(25)30(28-20-14-12-18-26(28)29)32-22-24(8-4)16-10-6-2/h11-14,17-20,23-24H,5-10,15-16,21-22H2,1-4H3
InChI Key:
ZXRULULEMFAFAS-UHFFFAOYSA-N
SMILES:
CCCCC(COc1c2ccccc2c(c2c1cccc2)OCC(CCCC)CC)CC
Properties
Complexity:
423
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.318g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
434.664g/mol
Monoisotopic Mass:
434.318g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
10.6
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