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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Related Compounds

  • 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
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  • 1-Acetyl-3-azetidinesulfonamide
  • 2-Azaspiro[3.3]heptane-6-sulfonamide
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