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1005-30-7

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Basic Information
CAS No.: 1005-30-7
Name: Benzoic acid, 4-iodo-, sodiuM salt
Article Data: 4
Molecular Structure:
Molecular Structure of 1005-30-7 (Benzoic acid, 4-iodo-, sodiuM salt)
Formula: C7H5 I O2 . Na
Molecular Weight: 270.002
Synonyms: Benzoicacid, 4-iodo-, sodium salt (9CI); Benzoic acid, p-iodo-, sodium salt (8CI);Sodium 4-iodobenzoate; Sodium p-iodobenzoate
Density: g/cm3
Boiling Point: 318.5°Cat760mmHg
Flash Point: 146.4°C
Safety: Moderately toxic by ingestion, intravenous, and intramuscular routes. When heated to decomposition it emits toxic fumes of I− and Na2O.
PSA: 40.13000
LogP: 0.65470
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Chemistry

Product Name: p-Iodobenzoic acid sodium salt (CAS NO.1005-30-7)


Molecular Formula: C7H4INaO2
Molecular Weight: 269.9997g/mol
Mol File: 1005-30-7.mol
Boiling point: 318.5 °C at 760 mmHg
Flash Point: 146.4 °C
Enthalpy of Vaporization: 59.12 kJ/mol
Vapour Pressure:  0.00015 mmHg at 25°C 
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of p-Iodobenzoic acid sodium salt (CAS NO.1005-30-7):
  IUPAC Name: sodium 4-iodobenzoate
  Canonical SMILES: C1=CC(=CC=C1C(=O)[O-])I.[Na+]
  InChI: InChI=1S/C7H5IO2.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H,9,10);/q;+1/p-1 
  InChIKey: PGOQXVXZIXKUSU-UHFFFAOYSA-M

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 540mg/kg (540mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 117, Pg. 307, 1956.
mouse LD50 oral 2500mg/kg (2500mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 43, Pg. 495, 1954.
rat LD50 intravenous 786mg/kg (786mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 32, Pg. 44, 1943.

Safety Profile

Moderately toxic by ingestion, intravenous, and intramuscular routes. When heated to decomposition it emits toxic fumes of I− and Na2O.

Specification

 p-Iodobenzoic acid sodium salt ,its CAS NO. is 1005-30-7,the synonyms is Sodium p-iodobenzoate ; Benzoic acid, p-iodo-, sodium salt .