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102296-77-5 | 1(2H)-Anthracenone, 3,4,5,6,7,8-hexahydro-4,5,5,8,8-pentamethyl-
CAS No: 102296-77-5 Catalog No: AG000751 MDL No:
Product Description
Catalog Number:
AG000751
Chemical Name:
1(2H)-Anthracenone, 3,4,5,6,7,8-hexahydro-4,5,5,8,8-pentamethyl-
CAS Number:
102296-77-5
Molecular Formula:
C19H26O
Molecular Weight:
270.4091
IUPAC Name:
4,5,5,8,8-pentamethyl-3,4,6,7-tetrahydro-2H-anthracen-1-one
InChI:
InChI=1S/C19H26O/c1-12-6-7-17(20)14-11-16-15(10-13(12)14)18(2,3)8-9-19(16,4)5/h10-12H,6-9H2,1-5H3
InChI Key:
QZJSOODUKJBQTN-UHFFFAOYSA-N
SMILES:
O=C1CCC(c2c1cc1c(c2)C(C)(C)CCC1(C)C)C
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.198g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.416g/mol
Monoisotopic Mass:
270.198g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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