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117022-38-5 | Chrysene, 1,12-dimethyl-
CAS No: 117022-38-5 Catalog No: AG000DKC MDL No:
Product Description
Catalog Number:
AG000DKC
Chemical Name:
Chrysene, 1,12-dimethyl-
CAS Number:
117022-38-5
Molecular Formula:
C20H16
Molecular Weight:
256.3410
IUPAC Name:
1,12-dimethylchrysene
InChI:
InChI=1S/C20H16/c1-13-6-5-9-18-17-11-10-15-7-3-4-8-16(15)19(17)12-14(2)20(13)18/h3-12H,1-2H3
InChI Key:
AXVTWAFNLDFUEU-UHFFFAOYSA-N
SMILES:
Cc1cc2c3ccccc3ccc2c2c1c(C)ccc2
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:
6.4
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