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1,6-Diiodohexane 97%

CAT: 0286-D31440-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-D31440-01Size:5 g
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CAS Number
629-09-4
Synonyms
Hexamethylene diiodide
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00001103
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled.
DOT Name
Not D.O.T.-Regulated
Precautions
P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; 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.

Chemical Information

1,6-Diiodohexane
CAS Number629-09-4
PubChem CID12373
IUPAC Name1,6-diiodohexane
Molecular FormulaC6H12I2
Molecular Weight337.97
XLogP4.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count5
Heavy Atom Count8
Formal Charge0
Complexity31
SMILES
C(CCCI)CCI
InChI
InChI=1S/C6H12I2/c7-5-3-1-2-4-6-8/h1-6H2
InChIKey
QLIMAARBRDAYGQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,6-Diiodohexane
CAS: 629-09-4
CID: 12373
Formula: C6H12I2
MW: 337.97
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight337.97
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count5
Exact Mass337.90285
Monoisotopic Mass337.90285
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity31.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes