CAS 77-90-7|Tributyl citrate acetate

Introduction：Basic information about CAS 77-90-7|Tributyl citrate acetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Tributyl citrate acetate BiologicalActivity
3. Chemical & Physical Properties
4. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
5. Safety Information
6. Customs
7. Articles29
8. Synonyms

Common Name	Tributyl citrate acetate
CAS Number	77-90-7	Molecular Weight	402.479
Density	1.1±0.1 g/cm3	Boiling Point	418.1±40.0 °C at 760 mmHg
Molecular Formula	C₂₀H₃₄O₈	Melting Point	-59 °C
MSDS	ChineseUSA	Flash Point	175.1±27.4 °C

Names

Name	Tributyl 2-acetylcitrate
Synonym	More Synonyms

Tributyl citrate acetate BiologicalActivity

Description	Acetyl tributyl citrate (Tributyl O-acetylcitrate; ATBC) is an alternative plasticizer[1].
Related Catalog	Research 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

Density	1.1±0.1 g/cm3
Boiling Point	418.1±40.0 °C at 760 mmHg
Melting Point	-59 °C
Molecular Formula	C₂₀H₃₄O₈
Molecular Weight	402.479
Flash Point	175.1±27.4 °C
Exact Mass	402.225372
PSA	105.20000
LogP	6.92
Vapour Pressure	0.0±1.0 mmHg at 25°C
Index of Refraction	1.458
InChIKey	QZCLKYGREBVARF-UHFFFAOYSA-N
SMILES	CCCCOC(=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 Equipment	Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
Hazard Codes	Xi
Safety Phrases	S24/25
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	TZ8330000
HS Code	2918150000

Customs

HS Code	2918150000
Summary	2918150000. 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

Intestinal pregnane X receptor links xenobiotic exposure and hypercholesterolemia.

Mol. Endocrinol. 29 , 765-76, (2015)

Recent studies have associated endocrine-disrupting chemical (EDC) exposure with the increased risk of cardiovascular disease in humans, but the underlying mechanisms responsible for these association...

Mechanistic analysis of PLGA/HPMC-based in-situ forming implants for periodontitis treatment.

Eur. J. Pharm. Biopharm. 94 , 273-83, (2015)

In-situ forming implant formulations based on poly(lactic-co-glycolic acid) (PLGA), acetyltributyl citrate (ATBC), minocycline HCl, N-methyl pyrrolidone (NMP) and optionally hydroxypropyl methylcellul...

Effect of PMMA polymer on the dynamic viscoelasticity and plasticizer leachability of PEMA-based tissue conditioners.

Dent. Mater. J. 29(4) , 374-80, (2010)

The purpose of this study was to determine the effect of PMMA polymer on dynamic viscoelasticity and plasticizer leachability of PEMA-based tissue conditioners. One PEMA polymer and one PMMA polymer w...

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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