4,5-Methanochrysene

CAT: 0024-sc-482574ASize: 25 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-482574ASize:25 mg

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CAS Number

202-98-2

Chemical Information

4H-Cyclopenta(def)chrysene

4H-Cyclopenta[def]chrysene is a carbopolycyclic compound.

CAS Number	202-98-2
PubChem CID	67458
IUPAC Name	pentacyclo[14.2.1.03,8.09,18.012,17]nonadeca-1,3,5,7,9(18),10,12(17),13,15-nonaene
Molecular Formula	C19H12
Molecular Weight	240.3
XLogP	5.7
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	19
Formal Charge	0
Complexity	359

SMILES

C1C2=CC=CC3=C2C4=C(C=C3)C5=CC=CC=C5C=C41

InChI

InChI=1S/C19H12/c1-2-7-16-13(4-1)10-15-11-14-6-3-5-12-8-9-17(16)19(15)18(12)14/h1-10H,11H2

InChIKey

GTDQLJVKXFXBMM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 202-98-2

CID: 67458

Formula: C19H12

MW: 240.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.3
XLogP3	5.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	240.093900383
Monoisotopic Mass	240.093900383
Topological Polar Surface Area	0 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	359
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
sc-356916A	4,4,5,5,5-Pentafluoropentanoic acid
sc-356916	4,4,5,5,5-Pentafluoropentanoic acid
sc-233041	4,4'-Dimethyl-5,5'-diphenyltetrathiafulvalene
sc-290819	5-bromo-4,4,5,5-tetrafluoropentanoic acid
sc-233018	4,4,5,5,5-Pentafluoro-1-pentanol
sc-478852	1-Pentene-4,4,5,5,5-d5
sc-262522	5-Bromo-4,4,5,5-tetrafluoropentan-1-ol
sc-262223	4,5,5,5-Tetrafluoro-4- (trifluoromethyl) valeric acid
sc-479017	9-[ (4,4,5,5,5-Pentafluoropentyl) thio]nonanol
sc-504292	9-Bromononyl 4,4,5,5,5-pentafluoropentyl Sulfide

Catalog	Name
433741-01	4,5-Methanochrysene
433742	4,5-Methanochrysene-d12
019236	4,4,5,5,5-Pentafluoropentanol
PC107473	4,4,5,5,5-Pentafluoropentoxybenzene
PC107421	4- (4,4,5,5,5-Pentafluoropentoxy) phenol
PC51374	4- (4,4,5,5,5-Pentafluoropentoxy) aniline
PC107419	4- (4,4,5,5,5-Pentafluoropentoxy) benzonitrile
JH920565	4,4,5,5-Tetramethylimidazolidine
TRC-D841240-500MG	4,5-Diethenyl-4,5-dihydro-4,5-pyrenediol
PC107527	4-[ (4,4,5,5,5-Pentafluoropentyl) amino]phenol