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1,4-Phenylenediamine DihydrIodide

Catalog Number
ACM116469024-1
CAS Number
116469-02-4
Product Name
1,4-Phenylenediamine DihydrIodide
Category
Perovskite Solar Cell (PSC) Materials
Synonyms
1,4-Diaminobenzene DihydroIodide; 1,4-Phenylenediammonium Iodide
IUPAC Name
benzene-1,4-diamine;dihydroiodide
Molecular Weight
363.97 g/mol
Molecular Formula
C6H8N2•2HI
Canonical SMILES
C1=CC(=CC=C1N)N.I.I
InChI
InChI=1S/C6H8N2.2HI/c7-5-1-2-6(8)4-3-5;;/h1-4H,7-8H2;2*1H
InChI Key
RYYSZNVPBLKLRS-UHFFFAOYSA-N
Melting Point
259 °C
Purity
>98.0%(T)
Appearance
White to Brown to Dark purple powder to crystal
Storage
Store under inert gas
Color
White to Brown to Dark purple Powder to crystal
Complexity
54.9
Covalently-Bonded Unit Count
3
Exact Mass
363.89334g/mol
Form
Solid
Formal Charge
0
Hazard Statements
H302 + H312 + H332 : Harmful if swallowed, in contact with skin or if inhaled.H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
10
MDL Number
MFCD28369273
Monoisotopic Mass
363.89334g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P261 : Avoid breathing dust/ fume/ gas/ mist/ vapors/ spray.P270 : Do not eat, drink or smoke when using this product.P271 : Use only outdoors or in a well-ventilated area.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.P302 + P352 + P312 : IF ON SKIN: Wash with plenty of water.Call a POISON CENTER/doctor if you feel unwell.P304 + P340 + P312 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Call a POISON CENTER/doctor if you feel unwell.
Rotatable Bond Count
0
Signal Word
Warning
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