2,3,5-Iodobenzoic acid

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Names

[ CAS No. ]:
88-82-4

[ Name ]:
2,3,5-Iodobenzoic acid

[Synonym ]:
2,3,5-triiodo-benzoic acid
Caswell No. 890A
2,3,5-TIBA
QVR BI CI EI
2-iodoyl-3,5-diiodobenzoic acid
Benzoic acid,2,3,5-triiodo
tib
Floraltone
2,3,4,6-TETRA-O-BENZYL-D-GALACTOPYRANOSE TRICHLOROACETIMIDATE
EINECS 201-859-6
2,3,5-Triiodobenzoic acid
Benzoic acid, 2,3,5-triiodo-
TIBA
Triiodobenzoic acid
2,3,5-Tri-iodobenzoic acid
Johnkolor
MFCD00002420
2,3,5-Iodobenzoic acid

Chemical & Physical Properties

[ Density]:
3.0±0.1 g/cm3

[ Boiling Point ]:
456.7±45.0 °C at 760 mmHg

[ Melting Point ]:
220-222 °C(lit.)

[ Molecular Formula ]:
C₇H₃I₃O₂

[ Molecular Weight ]:
499.81

[ Flash Point ]:
230.0±28.7 °C

[ Exact Mass ]:
499.726685

[ PSA ]:
37.30000

[ LogP ]:
3.87

[ Vapour Pressure ]:
0.0±1.2 mmHg at 25°C

[ Index of Refraction ]:
1.800

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DH9275000

CHEMICAL NAME :: Benzoic acid, 2,3,5-triiodo-

CAS REGISTRY NUMBER :: 88-82-4

BEILSTEIN REFERENCE NO. :: 1955088

LAST UPDATED :: 199701

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C7-H3-I3-O2

MOLECULAR WEIGHT :: 499.80

WISWESSER LINE NOTATION :: QVR BI CI EI

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 :: 813 mg/kg

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

REFERENCE :: GUCHAZ Guide to the Chemicals Used in Crop Protection. (Information Canada, 171 Slater St., Ottawa, Ont., Canada) Volume(issue)/page/year: 6,504,1973

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 700 mg/kg

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

REFERENCE :: QJPPAL Quarterly Journal of Pharmacy & Pharmacology. (London, UK) V.2-21, 1929-48. For publisher information, see JPPMAB. Volume(issue)/page/year: 19,483,1946

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 562 mg/kg

TOXIC EFFECTS :: Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1020,1968

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >200 mg/kg

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

REFERENCE :: JOCEAH Journal of Organic Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1936- Volume(issue)/page/year: 22,1686,1957

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22

[ Safety Phrases ]:
S22-S26-S36-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
DH9275000

[ HS Code ]:
29163900

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Benzoic acid,2-amino-3,5-diiodo-
Benzoic acid, 2-amino-, potassium salt (1:1)
Anthranilic acid
2-Amino-5-iodobenzoic acid

DownStream

3,5-Diiodobenzyl alcohol
2,3,5-triiodobenzoyl chloride
Carbonic acid hexyl 3,5-diiodobenzyl ester

Customs

[ HS Code ]: 2916399015

[ Summary ]:
2916399015 2,3,5-triiodobenzoic acid。supervision conditions:s(import or export registration certificate for pesticides)。VAT:17.0%。tax rebate rate:0.0%。MFN tarrif:6.5%。general tariff:30.0%

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2,3,5,6-tetrafluoro-4-iodo-benzoic acid
2-[[[[(3,5-DIMETHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
2-[[[(3,5-DIBROMO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
2-[[[[3-(5-BROMO-2-METHOXYPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
2,3-Difluoro-5-iodobenzoic acid
2,3-dimethoxy-5-iodobenzoic acid
1-[2-(2-Fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-ol
3-[(Oxane-4-sulfinyl)methyl]aniline
[2-(4-Methoxyphenyl)ethyl](3-methoxypropyl)amine
tert-butyl N-(1-benzyl-2,3,5,6-tetramethylpiperidin-4-yl)carbamate
1-Benzyl-2,3,5,6-tetramethylpiperidin-4-amine
tert-butyl N-(1-benzyl-2,3,5-trimethylpiperidin-4-yl)carbamate
Tert-butyl 1-benzyl-2-methylpiperidin-4-ylcarbamate
tert-butyl N-(1-benzyl-2-methylpiperidin-3-yl)carbamate
1-Methoxy-4-methylpentan-3-one
1-Benzyl-2,5-dimethylpiperidin-3-one

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