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1-Bromo-3-methylbutane

CAT: 0572-TRC-B685555-250GSize: 250 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-B685555-250GSize:250 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
107-82-4
Synonyms
3-Methyl-1-bromobutane; 3-Methylbutyl Bromide; 4-Bromo-2-methylbutane; Isoamyl Bromide; Isobutylmethyl Bromide; Isopentyl Bromide; NSC 9240
Hazard Statement
Highly flammable liquid and vapour; UN number: UN2341; Packing Group: III
Purity
>95% (GC)
Smiles
CC(CCBr)C
Molecular Formula
C5H11Br
Molecular Weight
151.04
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

1-Bromo-3-methylbutane

1-bromo-3-methylbutane appears as a colorless liquid. Slightly soluble in water and denser than water. Vapors are heavier than air.

CAS Number107-82-4
PubChem CID7891
IUPAC Name1-bromo-3-methylbutane
Molecular FormulaC5H11Br
Molecular Weight151.04
XLogP2.7
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity25
SMILES
CC(C)CCBr
InChI
InChI=1S/C5H11Br/c1-5(2)3-4-6/h5H,3-4H2,1-2H3
InChIKey
YXZFFTJAHVMMLF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Bromo-3-methylbutane
CAS: 107-82-4
CID: 7891
Formula: C5H11Br
MW: 151.04
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.04
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count2
Exact Mass150.00441
Monoisotopic Mass150.00441
Topological Polar Surface Area0 Ų
Heavy Atom Count6
Formal Charge0
Complexity25.1
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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