1-Chloro-2,3,4,5,6-pentafluorobenzene
Names
[ CAS No. ]:
344-07-0
[ Name ]:
1-Chloro-2,3,4,5,6-pentafluorobenzene
[Synonym ]:
EINECS 206-450-6
PENTAFLUOROCHLORO BENZENE
Chloropentafluorobenzene
chloropentafuorobenzene
MFCD00000534
Pentafluorophenyl chloride
Benzene, 1-chloro-2,3,4,5,6-pentafluoro-
Chloroperfluorobenzene
Benzene,chloropentafluoro
1-Chloro-2,3,4,5,6-pentafluorobenzene
Chemical & Physical Properties
[ Density]:
1.7±0.1 g/cm3
[ Boiling Point ]:
123.8±35.0 °C at 760 mmHg
[ Melting Point ]:
18.1ºC
[ Molecular Formula ]:
C6ClF5
[ Molecular Weight ]:
202.509
[ Flash Point ]:
29.5±19.4 °C
[ Exact Mass ]:
201.960876
[ LogP ]:
2.28
[ Vapour Pressure ]:
15.8±0.2 mmHg at 25°C
[ Index of Refraction ]:
1.422
[ Storage condition ]:
Refrigerator
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CZ1225500
- CHEMICAL NAME :
- Benzene, chloropentafluoro-
- CAS REGISTRY NUMBER :
- 344-07-0
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 11
- MOLECULAR FORMULA :
- C6-Cl-F5
- MOLECULAR WEIGHT :
- 202.51
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >4840 mg/m3/4H
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TCLo - Lowest published toxic concentration
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2500 mg/m3/6H/3W-I
- TOXIC EFFECTS :
- Liver - hepatitis (hepatocellular necrosis), diffuse Blood - changes in serum composition (e.g. TP, bilirubin, cholesterol) Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - phosphatases
- TYPE OF TEST :
- TCLo - Lowest published toxic concentration
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2500 mg/m3/6H/3W-I
- TOXIC EFFECTS :
- Liver - other changes Liver - changes in liver weight
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 10500 mg/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
MUTATION DATA
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Rodent - hamster Ovary
- DOSE/DURATION :
- 62500 ug/L
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD-A187-233 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 2 mg/m3 JAN 1993
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H315-H319-H335
[ Precautionary Statements ]:
P261-P305 + P351 + P338
[ Personal Protective Equipment ]:
Eyeshields;Faceshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
[ Hazard Codes ]:
Xn:Harmful;Xi:Irritant;
[ Risk Phrases ]:
R20
[ Safety Phrases ]:
S23-S24/25
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
2
[ RTECS ]:
CZ1225500
[ HS Code ]:
2903999090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ 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%
Articles
Rapid Commun. Mass Spectrom. 29(1) , 91-9, (2014)
Mass spectrometric identification of compounds in chromatography can be obtained from molecular masses from soft ionization mass spectrometry techniques such as field ionization (FI) and fragmentation...
Oxidative dehalogenation of perhalogenated benzenes by cytochrome P450 compound I.Biochemistry 46(20) , 5924-40, (2007)
Resolution of the identity PBE (RI-PBE) and B3LYP density functional theory calculations are used to understand the cytochrome P450-catalyzed, Compound I-mediated oxidation of perchlorobenzenes, perfl...
Catalytic and Noncatalytic Ammonolysis of Chloropentafluorobenzene. Selivanova GA, et al.Russ. J. Org. Chem. 37(3) , 404-9, (2001)