1,2-Dimethylchrysene

CAT: 0024-sc-497079Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-497079Size:10 mg

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CAS Number

15914-23-5

Chemical Information

1,2-Dimethylchrysene

CAS Number	15914-23-5
PubChem CID	27539
IUPAC Name	1,2-dimethylchrysene
Molecular Formula	C20H16
Molecular Weight	256.3
XLogP	6.8
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	20
Formal Charge	0
Complexity	346

SMILES

CC1=C(C2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C20H16/c1-13-7-9-18-16(14(13)2)11-12-19-17-6-4-3-5-15(17)8-10-20(18)19/h3-12H,1-2H3

InChIKey

DSPSZYVTOBHKHQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15914-23-5

CID: 27539

Formula: C20H16

MW: 256.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	256.3
XLogP3	6.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	256.125200510
Monoisotopic Mass	256.125200510
Topological Polar Surface Area	0 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	346
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
010401	1,2-Dimethylchrysene
MBS6053644-01	1,6-Dimethylchrysene
TRC-D471755-250MG	1,7-Dimethylchrysene
010404	1,8-Dimethylchrysene
TRC-D464940-10MG	3,11-Dimethylchrysene
TRC-D471767-50MG	3,11-Dimethylchrysene-D16
RG-E141219-01	1,1,2,2-Tetraethyl 1,1,2,2-ethanetetracarboxylate
RG-E140468-01	1,1,1,2,2,2-hexamethyldisilane
OR96366-01	1,1,1,2,2,2-Hexaphenyldisilane
JH432361	1,1,1,2-tetrafluoro-2- (1,2,2,2-tetrafluoroethoxy) ethane