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CAS 77-90-7 | Tributyl citrate acetate

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Common NameTributyl citrate acetate
CAS Number77-90-7Molecular Weight402.479
Density1.1±0.1 g/cm3Boiling Point418.1±40.0 °C at 760 mmHg
Molecular FormulaC20H34O8Melting Point-59 °C
MSDSChineseUSAFlash Point175.1±27.4 °C

Names

NameTributyl 2-acetylcitrate
SynonymMore Synonyms

Tributyl citrate acetate BiologicalActivity

DescriptionAcetyl tributyl citrate (Tributyl O-acetylcitrate; ATBC) is an alternative plasticizer[1].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
References

[1]. Andreia Alves, et al. Case Study on Screening Emerging Pollutants in Urine and Nails. Environ Sci Technol. 2017 Apr 4;51(7):4046-4053.  

Chemical & Physical Properties

Density1.1±0.1 g/cm3
Boiling Point418.1±40.0 °C at 760 mmHg
Melting Point-59 °C
Molecular FormulaC20H34O8
Molecular Weight402.479
Flash Point175.1±27.4 °C
Exact Mass402.225372
PSA105.20000
LogP6.92
Vapour Pressure0.0±1.0 mmHg at 25°C
Index of Refraction1.458
InChIKeyQZCLKYGREBVARF-UHFFFAOYSA-N
SMILESCCCCOC(=O)CC(CC(=O)OCCCC)(OC(C)=O)C(=O)OCCCC
Water Solubility<0.1 g/100 mL
Freezing Point-80℃

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ8330000
CHEMICAL NAME :
1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester
CAS REGISTRY NUMBER :
77-90-7
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C20-H34-O8

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>4 gm/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: 53,774,1964 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
12600 mg/kg/14D-I
TOXIC EFFECTS :
Blood - pigmented or nucleated red blood cells Blood - changes in erythrocyte (RBC) count Nutritional and Gross Metabolic - weight loss or decreased weight gain
REFERENCE :
JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 53,774,1964 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M3919 No. of Facilities: 88 (estimated) No. of Industries: 4 No. of Occupations: 4 No. of Employees: 1152 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M3919 No. of Facilities: 459 (estimated) No. of Industries: 3 No. of Occupations: 17 No. of Employees: 106672 (estimated) No. of Female Employees: 98182 (estimated)

Safety Information

Personal Protective EquipmentEyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
Hazard CodesXi
Safety PhrasesS24/25
RIDADRNONH for all modes of transport
WGK Germany3
RTECSTZ8330000
HS Code2918150000

Customs

HS Code2918150000
Summary2918150000. other salts and esters of citric acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:4ABXY(export license,certificate of inspection for goods inward,certificate of inspection for goods outwardexport license(processing trade),export license(border small volume trade)). MFN tariff:6.5%. General tariff:30.0%

Articles29

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Synonyms

Tributyl O-Acetylcitrate
MFCD00043554
EINECS 201-067-0
Citroflex A
tributyl acetylcitrate
1,2,3-Propanetricarboxylic acid, 2- (acetyloxy)-, tributyl ester
UNII-0ZBX0N59RZ
4OV1XVO4&OV1&1OV4
Acetyl tri-n-butyl citrate
ATBC
Tributyl 2-acetoxypropane-1,2,3-tricarboxylate
ACETYL TRIBUTYL CITRATE
Tributyl citrate acetate
Tributyl 2-acetoxy-1,2,3-propanetricarboxylate
Estaflex ATC
Citric acid, tributyl ester, acetate (8CI)
1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester
tributyl 2-(acetyloxy)propane-1,2,3-tricarboxylate
tributyl 2-acetyloxypropane-1,2,3-tricarboxylate

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