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117022-36-3 | Chrysene, 1,5-dimethyl-
CAS No: 117022-36-3 Catalog No: AG000DKD MDL No:
Product Description
Catalog Number:
AG000DKD
Chemical Name:
Chrysene, 1,5-dimethyl-
CAS Number:
117022-36-3
Molecular Formula:
C20H16
Molecular Weight:
256.3410
IUPAC Name:
1,5-dimethylchrysene
InChI:
InChI=1S/C20H16/c1-13-6-5-9-18-16(13)10-11-19-17-8-4-3-7-15(17)12-14(2)20(18)19/h3-12H,1-2H3
InChI Key:
WYLORHVCADFKHH-UHFFFAOYSA-N
SMILES:
Cc1cc2ccccc2c2c1c1cccc(c1cc2)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.125g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.348g/mol
Monoisotopic Mass:
256.125g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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