Sorbic acid

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Names

[ CAS No. ]:
110-44-1

[ Name ]:
Sorbic acid

[Synonym ]:
Sorbistat
2,4-Hexadienoic acid
EINECS 203-768-7
2,4-Hexadienoic acid, (E,E)-
trans-trans-2,4-Hexadienoic acid
MFCD00002703
sorbic
(2E,4E)-hexa-2,4-dienoic acid
sorbinic acid
trans,trans-sorbic acid
all-E-sorbic acid
Sorbic acid
trans,trans-2,4-hexadienoic acid
(2E,4E)hexa-2,4-dienoic acid
(E,E)-2,4-Hexadienoic acid
Sorbinsure
hexa-2
(E,E)-hexa-2,4-dienoic acid
(2E,4E)-2,4-Hexadienoic acid
C6:2n-2,4
hexadienoic acid
2,4-Hexadienoic acid, (2E,4E)-
Panosorb
FEMA 3921

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
233.0±9.0 °C at 760 mmHg

[ Melting Point ]:
132-135 °C(lit.)

[ Molecular Formula ]:
C6H8O2

[ Molecular Weight ]:
112.127

[ Flash Point ]:
139.9±9.6 °C

[ Exact Mass ]:
112.052429

[ PSA ]:
37.30000

[ LogP ]:
1.35

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.488

[ Stability ]:
Stability Material saturated with this acid may ignite spontaneously. Incompatible with strong oxidizing agents. May be light sensitive.

[ Water Solubility ]:
1.6 g/L (20 ºC)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
WG2100000
CHEMICAL NAME :
Sorbic acid
CAS REGISTRY NUMBER :
110-44-1
LAST UPDATED :
199701
DATA ITEMS CITED :
14
MOLECULAR FORMULA :
C6-H8-O2
MOLECULAR WEIGHT :
112.14
WISWESSER LINE NOTATION :
QV1U2U2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Human - man
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7360 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
800 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 :
3200 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2820 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 :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2820 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>1 gm/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 :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1040 mg/kg/65W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
1050 mg/L
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 22,501,1984 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 81510 No. of Facilities: 583 (estimated) No. of Industries: 6 No. of Occupations: 11 No. of Employees: 4662 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 81510 No. of Facilities: 4412 (estimated) No. of Industries: 45 No. of Occupations: 59 No. of Employees: 69243 (estimated) No. of Female Employees: 21637 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

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

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/38

[ Safety Phrases ]:
S26-S36-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
1

[ RTECS ]:
WG2100000

[ HS Code ]:
2916190090

Synthetic Route

Precursor & DownStream

Precursor

  • 2H-Pyran-2-one,tetrahydro-4-hydroxy-6-methyl-
  • 5-ethenyldihydro-2(3H)-Furanone
  • 2,4-Hexadienal
  • 2-(cyclohex-2-en-1-yloxy)acetic acid
  • Ethyl Sorbate
  • Crotonaldehyde
  • trimethyl-(2-trimethylsilyl-1-trimethylsilyloxyethenoxy)silane
  • 2,4-Hexadien-1-ol
  • 4-acetyloxyhex-5-enoic acid
  • trans-6-acetoxy-4-hexenoic acid

DownStream

  • 3-hexenoic acid
  • 4-HEXENOIC ACID
  • fumaric acid
  • Sorbic chloride
  • sodium sorbate
  • 1,3,5-Benzenetricarbaldehyde
  • 2-chlorobenzene-1,3,5-tricarbaldehyde
  • METHYL-A-L-ACOSAMINE
  • Methyl Sorbate

Customs

[ HS Code ]: 2916190090

[ Summary ]:
2916190090 unsaturated acyclic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

Articles

Influence of genetic polymorphism on t,t-MA/S-PMA ratio in 301 benzene exposed subjects.

Toxicol. Lett. 231(2) , 205-12, (2014)

This study investigated the effect of polymorphic genes GSTT1, GSTM1, GSTA1, EHPX1, NQO1, CYP2E1, CYP1A and MPO on the urinary concentrations and ratio (R) of the benzene metabolites trans,trans-mucon...

Simultaneous determination of eleven preservatives in cosmetics by micellar electrokinetic chromatography.

J. AOAC Int. 95(4) , 1069-73, (2012)

A new method for the simultaneous quantitation of 11 preservatives-imidazolidinyl urea, benzyl alcohol, dehydroacetic acid, sorbic acid, phenoxyethanol, benzoic acid, salicylic acid, and four parabens...

Coformer screening using thermal analysis based on binary phase diagrams.

Pharm. Res. 31(8) , 1946-57, (2014)

The advent of cocrystals has demonstrated a growing need for efficient and comprehensive coformer screening in search of better development forms, including salt forms. Here, we investigated a coforme...


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Related Compounds

  • sorbic acid
  • sorbic acid
  • SORBIC ACID K SALT
  • sorbic acid sodium
  • sorbic acid chloride
  • 6-propyl-sorbic acid
  • Methyl 3-(3-methoxybenzamido)-5-phenylthiophene-2-carboxylate
  • 4-Bromo-1-(2-ethoxyethoxy)-2-fluorobenzene
  • N,N'-di(ethoxycarbonyl)-3,5-diaminopyridine
  • N-(4-(aminomethyl)benzyl)(pyridin-2-yl)methanamine
  • (5,6,7,8-Tetrahydroquinolin-8-yl)methanamine
  • Methyl 4-amino-5-chloro-2-methoxy-3-methylbenzoate
  • 4-Amino-5-chloro-2-methoxy-3-methylbenzoic acid
  • 6-Chloro-2,3-dimethoxybenzenamine
  • tert-Butyl cis-4-(aminomethyl)-3-methoxypiperidine-1-carboxylate
  • 2,5-Di-(2-acetoxyethoxy)aniline
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