3-Chloropropionic Acid

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Names

[ CAS No. ]:
107-94-8

[ Name ]:
3-Chloropropionic Acid

[Synonym ]:
3-Chloropropanoic acid
MFCD00002764
EINECS 203-534-4
3-Chloropropionic acid

Chemical & Physical Properties

[ Density]:
1,27 g/cm3

[ Boiling Point ]:
203-205 °C(lit.)

[ Melting Point ]:
37 °C

[ Molecular Formula ]:
C3H5ClO2

[ Molecular Weight ]:
108.52400

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
107.99800

[ PSA ]:
37.30000

[ LogP ]:
0.69990

[ Vapour Pressure ]:
0.147mmHg at 25°C

[ Index of Refraction ]:
1.4398 (40ºC)

[ Water Solubility ]:
freely soluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UE8750000
CHEMICAL NAME :
Propionic acid, 3-chloro-
CAS REGISTRY NUMBER :
107-94-8
BEILSTEIN REFERENCE NO. :
1098495
LAST UPDATED :
199710
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C3-H5-Cl-O2
MOLECULAR WEIGHT :
108.53
WISWESSER LINE NOTATION :
QV2G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1040 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
730 mg/kg/4W-I
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Lungs, Thorax, or Respiration - tumors

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
100 ug/plate
REFERENCE :
DHEFDK HEW Publication (FDA. United States). (Washington, DC) ?-1979(?). For publisher information, see HPFSDS. Volume(issue)/page/year: FDA-78-1046,1978 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 5 mg/m3 JAN 1993

Safety Information

[ Symbol ]:

GHS05

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H314

[ Precautionary Statements ]:
P280-P305 + P351 + P338-P310

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges

[ Hazard Codes ]:
C:Corrosive;

[ Risk Phrases ]:
R21/22;R34

[ Safety Phrases ]:
S26-S36/37/39-S45

[ RIDADR ]:
UN 3261 8/PG 2

[ WGK Germany ]:
1

[ RTECS ]:
UE8750000

[ Packaging Group ]:
III

[ Hazard Class ]:
8

[ HS Code ]:
29159080

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Acrylic acid
  • 3-chloropropiononitrile
  • hydracrylonitrile
  • β-Propiolactone
  • 3-Chloro-1-propanol
  • 1,1,1,3-Tetrachloropropane
  • Acrylonitrile
  • 3-Bromopropanoic acid
  • 3-chloroperpropionic acid

DownStream

  • 3-cyclohexylsulfanylpropanoic acid
  • Propanoicacid, 3-[(6,9-dihydro-2-methyl-6-oxo-1H-purin-8-yl)thio]-
  • 3-(4-Cyanophenoxy)propionic Acid
  • 3-(4-CARBAMOYLPHENOXY)PROPIONIC ACID
  • 3-chlor-1-(4-methoxyphenyl)propan-1-on
  • ETHYLENEDIAMINE-N,N'-DIPROPIONIC ACID DIHYDROCHLORIDE
  • n-Dibutyl sulfide
  • 5,6-Dithiadecane
  • Propanoic acid,3-(butylthio)-

Customs

[ HS Code ]: 2915900090

[ Summary ]:
2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

Articles

Incorporation of chlorinated alkanes into fatty acids of hydrocarbon-utilizing mycobacteria.

J. Bacteriol. 156(3) , 1158-64, (1983)

The cellular fatty acid composition of Mycobacterium vaccae JOB5 and Mycobacterium convolutum R22 was examined after growth on n-alkanes and compared with the fatty acids of the organisms after growth...

Demixing of severely overlapped ¹H NMR resonances and interpretation of anomalous intensity pattern of dipolar coupled A₃ spins in a weakly aligning medium.

J. Magn. Reson. 207(2) , 190-6, (2010)

We report a single (13)C spin edited selective proton-proton correlation experiment to decipher overcrowded (13)C coupled proton NMR spectra of weakly dipolar coupled spin systems. The experiment unra...

Reductive dehalogenation of halocarboxylic acids by the phototrophic genera Rhodospirillum and Rhodopseudomonas.

Appl. Environ. Microbiol. 63(8) , 3333-5, (1997)

Type strains of the purple nonsulfur species Rhodospirillum rubrum, Rhodospirillum photometricum, and Rhodopseudomonas palustris grew phototrophically on a number of two- and three-carbon halocarboxyl...


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Related Compounds

  • 3-chloropropionic acid, [1-14c]
  • 2-methyl-3-chloropropionic acid
  • Trifluoro-3-chloropropionic acid
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  • nitrile of 3-chloropropionic acid
  • 3-Chloropropionic acid sodium salt
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