12-Fluoro-5-methylchrysene

Modify Date: 2025-08-27 19:13:35

12-Fluoro-5-methylchrysene structure	Common Name	12-Fluoro-5-methylchrysene
	CAS Number	61413-38-5	Molecular Weight	260.30500
	Density	1.226g/cm3	Boiling Point	452.4ºC at 760 mmHg
	Molecular Formula	C₁₉H₁₃F	Melting Point	N/A
	MSDS	N/A	Flash Point	199.4ºC

Name	12-Fluoro-5-methylchrysene
Synonym	More Synonyms

Density	1.226g/cm3
Boiling Point	452.4ºC at 760 mmHg
Molecular Formula	C₁₉H₁₃F
Molecular Weight	260.30500
Flash Point	199.4ºC
Exact Mass	260.10000
LogP	5.59370
Index of Refraction	1.728
InChIKey	PKWOZBMMJBJRKD-UHFFFAOYSA-N
SMILES	Cc1cc2ccccc2c2cc(F)c3ccccc3c12

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GC1270000

CHEMICAL NAME :: Chrysene, 12-fluoro-5-methyl-

CAS REGISTRY NUMBER :: 61413-38-5

LAST UPDATED :: 199612

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C19-H13-F

MOLECULAR WEIGHT :: 260.32

WISWESSER LINE NOTATION :: L E6 D666J C1 KF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 4 mg/kg/I

TOXIC EFFECTS :: Tumorigenic - neoplastic by RTECS criteria Skin and Appendages - tumors

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 40 mg/kg/3W-I

TOXIC EFFECTS :: Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 20 ug/plate

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 21,38,1978

HS Code	2903999090

1-(4-fluoro-1-n...

CAS#:316-68-7

Benzyl bromide

CAS#:100-39-0

12-Fluoro-5-met...

CAS#:61413-38-5

Literature: Hecht; Loy; Mazzarese; Hoffmann Journal of medicinal chemistry, 1978 , vol. 21, # 1 p. 38 - 44

HS Code	2903999090
Summary	2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

5-Methyl-12-fluorochrysene

12-Fluor-5-methylchrysen

CHRYSENE,12-FLUORO-5-METHYL

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12-Fluoro-5-methylchrysene

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Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

Safety Information

Synthetic Route

Customs

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.