3-Chloro-2-butanone

Names

[ Name ]:
3-Chloro-2-butanone

[Synonym ]:
EINECS 223-834-9
3-Chloro-2-butanone
MFCD00000865
1-Acetyl-1-Chloroethane
2-Butanone, 3-chloro-
3-chlorobutan-2-one
1-Chloroethyl Methyl Ketone

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
114.7±8.0 °C at 760 mmHg

[ Melting Point ]:
<-60ºC

[ Molecular Formula ]:
C₄H₇ClO

[ Molecular Weight ]:
106.551

[ Flash Point ]:
21.1±0.0 °C

[ Exact Mass ]:
106.018539

[ PSA ]:
17.07000

[ LogP ]:
0.77

[ Vapour Pressure ]:
19.7±0.2 mmHg at 25°C

[ Index of Refraction ]:
1.406

[ Water Solubility ]:
3 g/100 mL

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EL7062000

CHEMICAL NAME :: 2-Butanone, 3-chloro-

CAS REGISTRY NUMBER :: 4091-39-8

LAST UPDATED :: 199712

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C4-H7-Cl-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 810 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TOVEFN Toksikologicheskii Vestnik. (18-20 Vadkovskii per. Moscow, 101479, Russia) History Unknown Volume(issue)/page/year: (2),34,1996

Safety Information

[ Symbol ]:

GHS02, GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226-H302

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R10;R20/21/22;R36/37/38

[ Safety Phrases ]:
S16-S36/37/39-S26

[ RIDADR ]:
UN 1224 3/PG 3

[ WGK Germany ]:
3

[ RTECS ]:
EL7062000

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
2942000000

Precursor & DownStream

Precursor

2-Butanone
2-Chloro-2-butene
2,3-dimethyl-2-nitrooxirane
1-methylprop-1-enyl acetate
[2-(chloromethyl)-3-methyloxiran-2-yl]-trimethylsilane
2-nitrobut-2-ene
ch3cho
2-Butanol, 3-chloro-
Carbon tetrachloride

DownStream

4,5-Dimethylthiazole
2-Chloropropanoic acid
2-Acetoxy-3-butanone
UNII:99G79565PJ
3-(2-HYDROXY-PHENOXY)-BUTAN-2-ONE
Acetoin
2,3-dihydro-5,6-dimethyl-1,4-dithiin
2-(1-Methyl-2-oxopropyl)-1H-isoindole-1,3-(2H)-dione
4,5-dimethyl-1,3-oxazole
3-CHLORO-2-METHYL-2-BUTANOL

Customs

[ HS Code ]: 2914700090

[ Summary ]:
HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

Articles

Substrate specificity and enantioselectivity of 4-hydroxyacetophenone monooxygenase.

Appl. Environ. Microbiol. 69(1) , 419-26, (2003)

The 4-hydroxyacetophenone monooxygenase (HAPMO) from Pseudomonas fluorescens ACB catalyzes NADPH- and oxygen-dependent Baeyer-Villiger oxidation of 4-hydroxyacetophenone to the corresponding acetate e...

Synthesis and activity of ruthenium olefin metathesis catalysts coordinated with thiazol-2-ylidene ligands.

J. Am. Chem. Soc. 130(7) , 2234-45, (2008)

A new family of ruthenium-based olefin metathesis catalysts bearing a series of thiazole-2-ylidene ligands has been prepared. These complexes are readily accessible in one step from commercially avail...

Reaction of α-chloroketones with 1, 4-dianion of acetophenone n-ethoxy-carbonylhydrazone. Matsumura N, et al.

Tetrahedron Lett. 25(40) , 4529-32, (1984)

3-bromo-3-chloro-2-butanone
3-chloro-4-hydroxy-2-butanone
3-chloro-4-(4-chlorophenyl)-2-butanone
3-Chloro-4-hydroxy-1,4-diphenyl-2-butanone
3-chloro-2-(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)-4,5,6,7-tetrahydroindazole
3-chloro-2,4,5,6-tetrafluorophenol