CAS 2075-45-8|4-Bromopyrazole

Introduction:Basic information about CAS 2075-45-8|4-Bromopyrazole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name4-Bromopyrazole
CAS Number2075-45-8Molecular Weight146.97
Density1.9±0.1 g/cm3Boiling Point255.0±0.0 °C at 760 mmHg
Molecular FormulaC3H3BrN2Melting Point93-96 °C(lit.)
MSDSUSAFlash Point108.0±19.8 °C
Symbol
GHS07
Signal WordWarning

Names

Name4-bromo-1H-pyrazole
SynonymMore Synonyms

4-Bromopyrazole BiologicalActivity

Description4-Bromopyrazole is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related CatalogResearch Areas >>Others

Chemical & Physical Properties

Density1.9±0.1 g/cm3
Boiling Point255.0±0.0 °C at 760 mmHg
Melting Point93-96 °C(lit.)
Molecular FormulaC3H3BrN2
Molecular Weight146.97
Flash Point108.0±19.8 °C
Exact Mass145.947952
PSA28.68000
LogP1.44
Vapour Pressure0.0±0.5 mmHg at 25°C
Index of Refraction1.602
InChIKeyWVGCPEDBFHEHEZ-UHFFFAOYSA-N
SMILESBrc1cn[nH]c1

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ6200000
CHEMICAL NAME :
Pyrazole, 4-bromo-
CAS REGISTRY NUMBER :
2075-45-8
BEILSTEIN REFERENCE NO. :
0106510
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C3-H3-Br-N2
MOLECULAR WEIGHT :
146.99
WISWESSER LINE NOTATION :
T5MNJ DE

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
367 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
500 ug/plate
REFERENCE :
ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 8,611,1986

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXi:Irritant;
Risk PhrasesR36/37/38
Safety PhrasesS26-S37/39
RIDADRNONH for all modes of transport
WGK Germany3
RTECSUQ6200000
HS Code2933199090

Customs

HS Code2933199090
Summary2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles8

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Playing it safe: The nontoxic cyanide source K4 [Fe(CN)6]·3H2O can be used for the cyanation of (hetero)aryl halides. The application of palladacycle catalysts prevents poisoning during catalyst forma...

Structural Diversity in the Reaction of Mono- and Disubstituted Pyrazoles with Titanium Tetrachloride. Importance of Hydrogen Bonding and Trends in cis/trans Geometry of Binary Adducts with Unidentate Ligands.

Inorg. Chem. 36(20) , 4415-4420, (1997)

Treatment of titanium tetrachloride with 3,5-di-tert-butylpyrazole affords the complexes [3,5-(C(CH(3))(3))(2)C(3)H(3)N(2)](2)[TiCl(6)] and (3,5-(C(CH(3))(3))(2)C(3)HN(2))(2)TiCl(2) in 37 and 42% yiel...

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Dalton Trans. 42(11) , 3908-18, (2013)

The reactions of 4-bromo-1-(2-chloroethyl)-1H-pyrazole prepared from 4-bromopyrazole with the in situ generated PhSNa, PhSeNa, Na(2)S and Na(2)Se have resulted in thio/selenoether ligands L1-L4 respec...

Synonyms

4-bromopyrazol
4-Bromopyrazole
T5MNJ DE
1H-Pyrazole,4-bromo
4-Bromo-1H-pyrazole
1H-Pyrazole, 4-bromo-
4-bromo-pyrazole
MFCD00075602
4-bromoimidazole
4,Br-pyrazole
4-Brompyrazole
PYRAZOLE,4-BROMO
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