Malonic acid

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Names

[ CAS No. ]:
141-82-2

[ Name ]:
Malonic acid

[Synonym ]:
Malonic acid
Propanedioic acid
MFCD00002707
EINECS 205-503-0
Methanedicarbonic acid
1,3-propanedioic acid

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
386.8±25.0 °C at 760 mmHg

[ Melting Point ]:
132-135 °C (dec.)(lit.)

[ Molecular Formula ]:
C3H4O4

[ Molecular Weight ]:
104.062

[ Flash Point ]:
201.9±19.7 °C

[ Exact Mass ]:
104.010956

[ PSA ]:
74.60000

[ LogP ]:
-0.56

[ Vapour Pressure ]:
0.0±1.9 mmHg at 25°C

[ Index of Refraction ]:
1.479

[ Storage condition ]:
Store at RT.

[ Stability ]:
Stable. Incompatible with oxidizing agents, reducing agents, bases.

[ Water Solubility ]:
1400 g/L (20 ºC)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OO0175000
CHEMICAL NAME :
Malonic acid
CAS REGISTRY NUMBER :
141-82-2
BEILSTEIN REFERENCE NO. :
1751370
LAST UPDATED :
199701
DATA ITEMS CITED :
11
MOLECULAR FORMULA :
C3-H4-O4
MOLECULAR WEIGHT :
104.07
WISWESSER LINE NOTATION :
QV1VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1310 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea Lungs, Thorax, or Respiration - cyanosis
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>8900 mg/m3/1H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
4 gm/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
10 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TEST SYSTEM :
Rodent - rat
DOSE/DURATION :
10080 mg/kg/6W
REFERENCE :
CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1980- Volume(issue)/page/year: 9,387,1988 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4746 No. of Facilities: 46 (estimated) No. of Industries: 2 No. of Occupations: 3 No. of Employees: 1913 (estimated) No. of Female Employees: 272 (estimated)

Safety Information

[ Symbol ]:

GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H318

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

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R22;R36/37/38

[ Safety Phrases ]:
S26-S36/39-S37/39

[ RIDADR ]:
3261

[ WGK Germany ]:
1

[ RTECS ]:
OO0175000

[ Packaging Group ]:
III

[ HS Code ]:
2917190090

Synthetic Route

Precursor & DownStream

Precursor

  • Hydroxypropionic acid
  • Dimethyl malonate
  • Diethyl malonate
  • carbon suboxide
  • 1,3-Propanediol
  • Linoleic acid
  • Ethyl 3-amino-3-oxopropanoate
  • Malonic dihydrazide
  • Carbon disulphide

DownStream

  • 3-(4-octadecoxyphenyl)prop-2-enoic acid
  • Dipropyl Malonate
  • 3-[3-(4-BROMO-PHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-ACRYLIC ACID
  • 3-[3-(4-FLUORO-PHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-ACRYLIC ACID
  • 3-(p-Fluorphenyl)-1-phenyl-pyrazol-4-yl-methylenmalon-saeure
  • 6-chloro-2-phenyl-4-quinolone
  • N,N-diethylethanamine,propanedioic acid
  • 2-Propenoic acid, 3,3'-(2-nitro-1,4-phenylene)bis- (en)
  • 3-(2-ETHYL-PHENYL)-ACRYLIC ACID
  • 9-Anthracenecarboxylic acid

Customs

[ HS Code ]: 2917190090

[ Summary ]:
2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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Related Compounds

  • malonic acid
  • d2-malonic acid
  • Malonic acid13C3
  • Malonic acid-2-13C
  • cetyl malonic acid
  • <13C2>-malonic acid