CAS 121-32-4|Ethyl vanillin

Introduction:Basic information about CAS 121-32-4|Ethyl vanillin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameEthyl vanillin
CAS Number121-32-4Molecular Weight166.174
Density1.2±0.1 g/cm3Boiling Point295.1±20.0 °C at 760 mmHg
Molecular FormulaC9H10O3Melting Point76 °C
MSDSChineseUSAFlash Point119.0±15.3 °C
Symbol
GHS07
Signal WordWarning

Names

Nameethyl vanillin
SynonymMore Synonyms

Ethyl vanillin BiologicalActivity

DescriptionEthylvanillin is a flavorant, about three times as potent as vanillin and is used in the production of chocolate.
Related CatalogSignaling Pathways >>Others >>OthersResearch Areas >>Others

Chemical & Physical Properties

Density1.2±0.1 g/cm3
Boiling Point295.1±20.0 °C at 760 mmHg
Melting Point76 °C
Molecular FormulaC9H10O3
Molecular Weight166.174
Flash Point119.0±15.3 °C
Exact Mass166.062988
PSA46.53000
LogP1.72
Vapour Pressure0.0±0.6 mmHg at 25°C
Index of Refraction1.574
InChIKeyCBOQJANXLMLOSS-UHFFFAOYSA-N
SMILESCCOc1cc(C=O)ccc1O
Water Solubilityslightly soluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CU6125000
CHEMICAL NAME :
Benzaldehyde, 3-ethoxy-4-hydroxy-
CAS REGISTRY NUMBER :
121-32-4
BEILSTEIN REFERENCE NO. :
1073761
LAST UPDATED :
199710
DATA ITEMS CITED :
16
MOLECULAR FORMULA :
C9-H10-O3
MOLECULAR WEIGHT :
166.19
WISWESSER LINE NOTATION :
VHR DQ CO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Human
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1590 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 :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1800 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 :
750 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 :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
760 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 :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3 gm/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 :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>7940 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 - guinea pig
DOSE/DURATION :
1140 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 :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4480 mg/kg/70D-I
TOXIC EFFECTS :
Cardiac - other changes Blood - changes in spleen Nutritional and Gross Metabolic - weight loss or decreased weight gain

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Fibroblast
DOSE/DURATION :
250 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: 22,623,1984 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M4743 No. of Facilities: 26 (estimated) No. of Industries: 2 No. of Occupations: 17 No. of Employees: 2343 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M4743 No. of Facilities: 2917 (estimated) No. of Industries: 20 No. of Occupations: 42 No. of Employees: 53949 (estimated) No. of Female Employees: 31080 (estimated)

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302-H315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXn:Harmful
Risk PhrasesR22;R36/37/38
Safety PhrasesS26-S36
RIDADRNONH for all modes of transport
WGK Germany1
RTECSCU6125000
Packaging GroupI; II; III
HS Code2912420000

Customs

HS Code2912420000
Summary2912420000 3-ethoxy-4-hydroxybenzaldehyde。Supervision conditions:None。VAT:17.0%。Tax rebate rate:13.0%。Lowest tariff:5.5%。General tariff:30.0%

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Synonyms

burbonal
FEMA 2464
vanirome
EINECS 204-464-7
Bourbonal
3-Ethoxy-4-hydroxybenzaldehyde,Ethylvanillin
Vanilal
VANILLAL
ETHOVAN
3-ethoxy
VHR DQ CO2
ethylvanillin
4-hydroxy-3-ethoxybenzaldehyde
4-OH-3-OEtC6H3CHO
Vanirom
3-Ethoxy-4-hydroxybenzaldehyde
Vanbeenol
MFCD00006944
Ethyl Vanillin
Benzaldehyde, 3-ethoxy-4-hydroxy-
Ethavan
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