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3-Iodopentane

CAT: 0286-I03560-02Size: 100 gDry Ice: NoHazardous: Yes
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CAT#:0286-I03560-02Size:100 g
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CAS Number
1809-05-8
UN Code
UN1993
Pictogram
02 - Flammable; 07 - Irritant
UDF Signal Word
Warning
Hazard Statement
H226 Flammable liquid and vapor; 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
Flammable Liquids, N.O.S.
DOT Classification
Class 3
Packaging Group
PGIII
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; 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

3-Iodopentane
CAS Number1809-05-8
PubChem CID74549
IUPAC Name3-iodopentane
Molecular FormulaC5H11I
Molecular Weight198.05
XLogP3.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity23
SMILES
CCC(CC)I
InChI
InChI=1S/C5H11I/c1-3-5(6)4-2/h5H,3-4H2,1-2H3
InChIKey
VRQDQJYBWZERBW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Iodopentane
CAS: 1809-05-8
CID: 74549
Formula: C5H11I
MW: 198.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight198.05
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass197.99055
Monoisotopic Mass197.99055
Topological Polar Surface Area0 Ų
Heavy Atom Count6
Formal Charge0
Complexity23.1
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

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