CAS 106-70-7|Methyl hexoate

Introduction:Basic information about CAS 106-70-7|Methyl hexoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameMethyl hexoate
CAS Number106-70-7Molecular Weight130.185
Density0.9±0.1 g/cm3Boiling Point149.8±3.0 °C at 760 mmHg
Molecular FormulaC7H14O2Melting Point−71 °C(lit.)
MSDSChineseUSAFlash Point45.0±0.0 °C
Symbol
GHS02
Signal WordWarning

Names

Namemethyl hexanoate
SynonymMore Synonyms

Chemical & Physical Properties

Density0.9±0.1 g/cm3
Boiling Point149.8±3.0 °C at 760 mmHg
Melting Point−71 °C(lit.)
Molecular FormulaC7H14O2
Molecular Weight130.185
Flash Point45.0±0.0 °C
Exact Mass130.099380
PSA26.30000
LogP2.30
Vapour Pressure4.0±0.3 mmHg at 25°C
Index of Refraction1.406
InChIKeyNUKZAGXMHTUAFE-UHFFFAOYSA-N
SMILESCCCCCC(=O)OC
StabilityStable. Flammable. Incompatible with strong oxidizing agents, strong bases.

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MO8401400
CHEMICAL NAME :
Hexanoic acid, methyl ester
CAS REGISTRY NUMBER :
106-70-7
BEILSTEIN REFERENCE NO. :
1744683
LAST UPDATED :
199710
DATA ITEMS CITED :
10
MOLECULAR FORMULA :
C7-H14-O2
MOLECULAR WEIGHT :
130.21

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,745,1982
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
14 gm/m3/2H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,82,1982
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
48 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
RESJAS Journal of the Reticuloendothelial Society. (1964) (Res: Journal of the Reticuloendothelial Society, New York) V.1(1)-14(6), 1964-73. Volume(issue)/page/year: 3,250,1966
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,745,1982
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
11500 mg/m3
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 51(5),61,1986 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 1 mg/m3 JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M0807 No. of Facilities: 28 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 476 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M0807 No. of Facilities: 42 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 255 (estimated)

Safety Information

Symbol
GHS02
Signal WordWarning
Hazard StatementsH226
Precautionary StatementsP210-P370 + P378
Personal Protective EquipmentEyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard CodesF+
Risk PhrasesR10
Safety PhrasesS43-S16
RIDADRUN 3272 3/PG 3
WGK Germany1
RTECSMO8401400
Packaging GroupIII
Hazard Class3
HS Code29159080

Customs

HS Code2915900090
Summary2915900090 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%

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Synonyms

EINECS 203-425-1
Caproic acid methyl ester
Methyl n-hexoate
Methyl hexoate
Methyl hexanoate
Hexanoic acid,methyl ester
Caproic acid methyl ester,Methyl caproate
Hexanoic acid, methyl ester
Hexanoic acid methyl ester
Methyl caproate
Methyl capronate
Caproic acid, methyl ester
Caprylic acid methyl ester
Caproic acid methyl ester,Hexanoic acid methyl ester,Methyl caproate
Methyl hexylate
Methyl n-hexanoate
methyl butylacetate
MFCD00009510
n-Caproic acid methyl ester
methyl n-caproate
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