CAS 141-04-8|Diisobutyl adipate

Introduction：Basic information about CAS 141-04-8|Diisobutyl adipate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Synonyms

Common Name	Diisobutyl adipate
CAS Number	141-04-8	Molecular Weight	258.354
Density	1.0±0.1 g/cm3	Boiling Point	281.1±8.0 °C at 760 mmHg
Molecular Formula	C₁₄H₂₆O₄	Melting Point	-17°C
MSDS	ChineseUSA	Flash Point	122.6±16.9 °C

Names

Name	Diisobutyl adipate
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.0±0.1 g/cm3
Boiling Point	281.1±8.0 °C at 760 mmHg
Melting Point	-17°C
Molecular Formula	C₁₄H₂₆O₄
Molecular Weight	258.354
Flash Point	122.6±16.9 °C
Exact Mass	258.183105
PSA	52.60000
LogP	3.85
Vapour Pressure	0.0±0.6 mmHg at 25°C
Index of Refraction	1.439
InChIKey	RDOFJDLLWVCMRU-UHFFFAOYSA-N
SMILES	CC(C)COC(=O)CCCCC(=O)OCC(C)C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AV1480000

CHEMICAL NAME :: Adipic acid, diisobutyl ester

CAS REGISTRY NUMBER :: 141-04-8

BEILSTEIN REFERENCE NO. :: 1791084

LAST UPDATED :: 199710

DATA ITEMS CITED :: 7

MOLECULAR FORMULA :: C14-H26-O4

MOLECULAR WEIGHT :: 258.40

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 5950 uL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 62,1596,1973

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 12300 uL/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2703360 ** REPRODUCTIVE DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intraperitoneal

DOSE :: 1190 mg/kg

SEX/DURATION :: female 5-15 day(s) after conception

TOXIC EFFECTS :: Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 62,1596,1973

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intraperitoneal

DOSE :: 595 mg/kg

SEX/DURATION :: female 5-15 day(s) after conception

TOXIC EFFECTS :: Reproductive - Specific Developmental Abnormalities - other developmental abnormalities

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 62,1596,1973

Safety Information

Personal Protective Equipment	Eyeshields;Gloves
Hazard Codes	Xi
Risk Phrases	R36/37/38
Safety Phrases	S26-S36/37/39
RIDADR	NONH for all modes of transport
WGK Germany	1
RTECS	AV1480000
HS Code	2917120090

Customs

HS Code	2917120090
Summary	2917120090. adipic acid and its salts. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

Synonyms

Diisobutyl adipate

Hexanedioic acid, bis(2-methylpropyl) ester

Hexanedioic acid 1,6-bis(2-methylpropyl) ester

EINECS 205-450-3

bis(2-methylpropyl) hexanedioate

Adipic Acid Diisobutyl Ester

MFCD00053722

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