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2-Butylbenzofuran

CAT: 0013-GTR19254223-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254223-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
2-Butylbenzofuran , with CAS No. 4265-27-4, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2-Butylbenzofuran provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
4265-27-4
Product Name Alternative
Compound 4265 27 4, Compound 4265274
Purity
97.13% (May vary between batches)
Smiles
CCCCc1cc2ccccc2o1
Molecular Formula
C12H14O
Molecular Weight
174.243
Storage Conditions
Pure form: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

2-Butylbenzofuran
CAS Number4265-27-4
PubChem CID77951
IUPAC Name2-butyl-1-benzofuran
Molecular FormulaC12H14O
Molecular Weight174.24
XLogP4.1
Topological Polar Surface Area13.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity155
SMILES
CCCCC1=CC2=CC=CC=C2O1
InChI
InChI=1S/C12H14O/c1-2-3-7-11-9-10-6-4-5-8-12(10)13-11/h4-6,8-9H,2-3,7H2,1H3
InChIKey
OVJKFJDEVKABNF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Butylbenzofuran
CAS: 4265-27-4
CID: 77951
Formula: C12H14O
MW: 174.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight174.24
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass174.104465066
Monoisotopic Mass174.104465066
Topological Polar Surface Area13.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity155
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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Alternative Products

CatalogName
TRC-B809275-1G2-Butylbenzofuran
OR89403-01N- (2-Butylbenzofuran-5-yl) methanesulfonamide
OR83643-01(2-Butylbenzofuran-3-yl) (4-methoxyphenyl) methanone
OR1005133N- (2-butylbenzofuran-5-yl) sulfonic amide
2648402-53-1-013-bromo-5-tert-butylbenzofuran
HY-W011453R(2-Butylbenzofuran-3-yl) (4-hydroxyphenyl) methanone (Standard)
OR1068642-01(2-Butylbenzofuran-3-yl) (4-hydroxy-3-iodophenyl) methanone
OR1063772-01(2-Butylbenzofuran-3-yl) (4-hydroxy-3,5-diiodophenyl) methanone
TRC-B809075-250MG(2-Butylbenzofuran-3-yl)(3-ethyl-4-(2-(ethylamino)ethoxy)phenyl)methanone
TRC-B809077-100MG(2-Butylbenzofuran-3-yl)(3-ethyl-4-(2-(ethylamino)ethoxy)phenyl)methanone-d4

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