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100602-08-2 | Chrysene, dodecahydro-
CAS No: 100602-08-2 Catalog No: AG0002GL MDL No:
Product Description
Catalog Number:
AG0002GL
Chemical Name:
Chrysene, dodecahydro-
CAS Number:
100602-08-2
Molecular Formula:
C18H24
Molecular Weight:
240.3832
IUPAC Name:
1,2,3,4,4a,4b,5,6,6a,7,8,9-dodecahydrochrysene
InChI:
InChI=1S/C18H24/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h7,10,12-13,16,18H,1-6,8-9,11H2
InChI Key:
OESCMXNUUMGAIU-UHFFFAOYSA-N
SMILES:
C1CCC2C(=CC=C3C2CCC2C3=CCCC2)C1
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.188g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.39g/mol
Monoisotopic Mass:
240.188g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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