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1-Chlorobutane SG

CAT: 0063-17105163-01Size: 250 gDry Ice: NoHazardous: No
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CAT#:0063-17105163-01Size:250 g
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CAS Number
109-69-3

Chemical Information

Butyl Chloride

Butyl chloride appears as a water white liquid with a sharp odor. Flash point 20 °F. Boiling point 77-78 °C (173 °F). Density 7.5 lb / gal. Slightly soluble in water. Vapors are heavier than air. Used in the manufacture of a variety of organic chemicals.

CAS Number109-69-3
PubChem CID8005
IUPAC Name1-chlorobutane
Molecular FormulaC4H9Cl
Molecular Weight92.57
XLogP2.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count5
Formal Charge0
Complexity13
SMILES
CCCCCl
InChI
InChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3
InChIKey
VFWCMGCRMGJXDK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butyl Chloride
CAS: 109-69-3
CID: 8005
Formula: C4H9Cl
MW: 92.57
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight92.57
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass92.0392780
Monoisotopic Mass92.0392780
Topological Polar Surface Area0 Ų
Heavy Atom Count5
Formal Charge0
Complexity13.1
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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