Benzoic acid,2-(acetyloxy)-5-bromo-

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Names

[ Name ]:
Benzoic acid,2-(acetyloxy)-5-bromo-

[Synonym ]:
5-bromo-2-acetoxybenzoic acid
5-Bromosalicylic acid acetate
2-Acetoxy-5-brom-benzoesaeure
5-Bromo-2-acetylsalicylic acid
5-bromoaspirin
5-Bromoacetylsalicylic acid
2-Acetoxy-5-bromobenzoic acid
Sedasprin
Bromoaspirin
acetyl-5-bromosalicylic acid

Chemical & Physical Properties

[ Density]:
1.662g/cm3

[ Boiling Point ]:
368.4ºC at 760mmHg

[ Melting Point ]:
60 °C

[ Molecular Formula ]:
C₉H₇BrO₄

[ Molecular Weight ]:
259.05300

[ Flash Point ]:
176.6ºC

[ Exact Mass ]:
257.95300

[ PSA ]:
63.60000

[ LogP ]:
2.07260

[ Vapour Pressure ]:
4.46E-06mmHg at 25°C

[ Index of Refraction ]:
1.585

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: VO1870000

CHEMICAL NAME :: Salicylic acid, 5-bromo-, acetate

CAS REGISTRY NUMBER :: 1503-53-3

BEILSTEIN REFERENCE NO. :: 2695058

LAST UPDATED :: 199612

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C9-H7-Br-O4

MOLECULAR WEIGHT :: 259.07

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 :: 1130 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity)

REFERENCE :: CRAAA7 Current Researches in Anesthesia and Analgesia. (Cleveland, OH) V.1-35, 1922-56. For publisher information, see AACRAT. Volume(issue)/page/year: 25,221,1946

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 650 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity)

REFERENCE :: CRAAA7 Current Researches in Anesthesia and Analgesia. (Cleveland, OH) V.1-35, 1922-56. For publisher information, see AACRAT. Volume(issue)/page/year: 25,221,1946 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 16800 mg/kg/8W-C

TOXIC EFFECTS :: Musculoskeletal - other changes Related to Chronic Data - death

REFERENCE :: CRAAA7 Current Researches in Anesthesia and Analgesia. (Cleveland, OH) V.1-35, 1922-56. For publisher information, see AACRAT. Volume(issue)/page/year: 25,221,1946

Safety Information

[ HS Code ]:
2918990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

5-Bromo-2-hydroxybenzoic acid
Ethanoic anhydride
Acetyl chloride

DownStream

6-BROMO-2-METHYLCHROMONE
5-Chlorosalicylamide
5-Bromo-2-hydroxybenzamide
(4-bromo-2-carbonochloridoylphenyl) acetate

Customs

[ HS Code ]: 2918990090

[ Summary ]:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

Benzoic acid,2-(acetyloxy)-5-iodo-
Benzoic acid,2-[(5-bromo-1-naphthalenyl)methyl]-
2-acetyloxy-5-aminobenzoic acid
2-acetyloxy-5-octylbenzoic acid
2-acetyloxy-5-(2-amino-2-carboxyethyl)benzoic acid
5-BROMO-2-[[[(2,4-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
rac-(3R,4S)-4-(but-3-yn-1-yl)pyrrolidin-3-ol
2-(1-Hydroxycyclobutyl)-2,3-dimethylbutanoic acid
6-Methyl-5-(2-methylpropyl)piperidin-3-ol
6-Methyl-5-propylpiperidin-3-ol
4-(5-Methylhexan-2-yl)oxolan-3-ol
2-[(3-Methoxycyclobutyl)methyl]cyclobutan-1-ol
4-[(4-Bromo-1,2-thiazol-5-yl)methyl]oxolan-3-ol
2,4,6-Triiodo-3-(trifluoromethyl)aniline
2-(4-Hydroxythian-4-yl)-2,3-dimethylbutanoic acid
2-(3-Hydroxy-1,1-dioxo-1lambda6-thiolan-3-yl)-2,3-dimethylbutanoic acid

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