ChemSpider 2D Image | Iodamide | C12H11I3N2O4

Iodamide

  • Molecular FormulaC12H11I3N2O4
  • Average mass627.940 Da
  • Monoisotopic mass627.785278 Da
  • ChemSpider ID3592

More details:



Featured data source



Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1922
207-125-1 [EINECS]
3-(acetylamino)-5-[(acetylamino)methyl]-2,4,6-triiodobenzoic acid
3-Acetamido-5-(acetamidomethyl)-2,4,6-triiodbenzoesäure [German] [ACD/IUPAC Name]
3-Acetamido-5-(acetamidomethyl)-2,4,6-triiodobenzoic acid [ACD/IUPAC Name]
440-58-4 [RN]
4RII332O0R
a,5-Diacetamido-2,4,6-triiodo-m-toluic Acid
Acide 3-acétamido-5-(acétamidométhyl)-2,4,6-triiodobenzoïque [French] [ACD/IUPAC Name]
ametriodinic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

B 4130 [DBID]
BRN 2175358 [DBID]
D01376 [DBID]
KBio2_001554 [DBID]
KBio2_004122 [DBID]
KBio2_006690 [DBID]
KBio3_001646 [DBID]
KBioGR_001276 [DBID]
KBioSS_001554 [DBID]
SH 926 [DBID]
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  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      V08AA03 Wikidata Q3801333
    • Chemical Class:

      A benzoic acid compound having iodo substituents at the 2-, 4- and 6-positions, an acetamido substituent at the 3-position and an acetamidomethyl substituent at the 5-position. ChEBI CHEBI:31703
    • Compound Source:

      synthetic; L-isomer: spectrum Microsource [01500772]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.4±0.1 g/cm3
Boiling Point: 683.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.3±3.0 kJ/mol
Flash Point: 367.1±31.5 °C
Index of Refraction: 1.745
Molar Refractivity: 104.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 72.8±3.0 dyne/cm
Molar Volume: 256.5±3.0 cm3

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