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12027-06-4 molecular structure
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amine hydroiodide

ChemBase ID: 103632
Molecular Formular: IN
Molecular Mass: 140.91117
Monoisotopic Mass: 140.90754701
SMILES and InChIs

SMILES:
N.I
Canonical SMILES:
N.I
InChI:
InChI=1S/HI.H3N/h1H;1H3
InChIKey:
UKFWSNCTAHXBQN-UHFFFAOYSA-N

Cite this record

CBID:103632 http://www.chembase.cn/molecule-103632.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
amine hydroiodide
IUPAC Traditional name
amine hydroiodide
Synonyms
Ammonium iodide
AMMONIUM IODIDE, ACS
碘化铵
CAS Number
12027-06-4
EC Number
234-717-7
MDL Number
MFCD00011424
PubChem SID
24853265
24852173
162102888
24845424
24846479
PubChem CID
16211035

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Lipinski's Rule of Five true  H Acceptors
H Donor LogD (pH = 5.5) -3.7525723 
LogD (pH = 7.4) -2.4393091  Log P -0.978 
Molar Refractivity 15.5149 cm3 Polarizability 2.2600515 Å3
Polar Surface Area 13.59 Å2 Rotatable Bonds

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
ethanol: slightly soluble expand Show data source
methanol: slightly soluble expand Show data source
Apperance
crystalline expand Show data source
Melting Point
551 °C(lit.) expand Show data source
Boiling Point
405 °C/1 atm(lit.) expand Show data source
Vapor Pressure
1 mm Hg at 210.9 °C expand Show data source
1 mmHg ( 210.9 °C) expand Show data source
pH
4.5-6.5 (20 °C, 5%) expand Show data source
4.5-6.5 (25 °C, 50 mg/mL in H2O) expand Show data source
Storage Condition
Room Temperature (15-30°C) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
R:36/37/38 expand Show data source
Safety Statements
26 expand Show data source
S:20-25-26-37/39 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
≥99% expand Show data source
≥99.0% (AT) expand Show data source
≥99.5% expand Show data source
99.999% trace metals basis expand Show data source
Grade
ACS expand Show data source
ACS reagent expand Show data source
puriss. expand Show data source
puriss. p.a. expand Show data source
REAGENT expand Show data source
SAJ special grade expand Show data source
Certificate of Analysis
Download expand Show data source
Ignition Residue
≤0.02% (as SO4) expand Show data source
≤0.05% expand Show data source
≤0.1% (as SO4) expand Show data source
Impurities
≤0.001% heavy metals (as Pb) expand Show data source
≤0.005% insolubles expand Show data source
≤0.01% thiosulfate (S2O3) expand Show data source
Cation Traces
As: ≤5 mg/kg expand Show data source
Ba: ≤0.002% expand Show data source
Ba: ≤20 mg/kg expand Show data source
Ca: ≤10 mg/kg expand Show data source
Cd: ≤5 mg/kg expand Show data source
Co: ≤5 mg/kg expand Show data source
Cr: ≤5 mg/kg expand Show data source
Cu: ≤1 mg/kg expand Show data source
Fe: ≤10 mg/kg expand Show data source
Fe: ≤2 mg/kg expand Show data source
Fe: ≤5 ppm expand Show data source
heavy metals (as Pb): ≤0.001% expand Show data source
K: ≤50 mg/kg expand Show data source
Mg: ≤5 mg/kg expand Show data source
Mn: ≤5 mg/kg expand Show data source
Na: ≤50 mg/kg expand Show data source
Ni: ≤5 mg/kg expand Show data source
Pb: ≤1 mg/kg expand Show data source
Zn: ≤5 mg/kg expand Show data source
Antion Traces
bromide, chloride (as Cl-): ≤50 mg/kg expand Show data source
chloride, bromide (as Cl)-: ≤200 mg/kg expand Show data source
Cl- and Br-: ≤0.005% expand Show data source
iodate (IO3-): ≤100 mg/kg expand Show data source
iodate (IO3-): ≤5 mg/kg expand Show data source
phosphate (PO43-): ≤0.001% expand Show data source
phosphate (PO43-): ≤10 mg/kg expand Show data source
sulfate (SO42-): ≤0.05% expand Show data source
sulfate (SO42-): ≤100 mg/kg expand Show data source
sulfate (SO42-): ≤20 mg/kg expand Show data source
Loss on Drying
≤1% loss on drying, 105 °C expand Show data source
Linear Formula
NH4I expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02152496 external link
ACS Reagent Grade
Sigma Aldrich - 203467 external link
Packaging
10, 50 g in amber poly
Sigma Aldrich - 221937 external link
Packaging
100, 500 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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