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Butyl acrylate

CAT: 0024-sc-239437Size: 1 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-239437Size:1 mL
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CAS Number
141-32-2

Chemical Information

Butyl Acrylate

Butyl acrylate is an acrylate ester obtained by the formal condensation of the hydroxy group of butan-1-ol with the carboxy group of acrylic acid. It is functionally related to an acrylic acid and a butan-1-ol.

CAS Number141-32-2
PubChem CID8846
IUPAC Namebutyl prop-2-enoate
Molecular FormulaC7H12O2
Molecular Weight128.17
XLogP2.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity97
SMILES
CCCCOC(=O)C=C
InChI
InChI=1S/C7H12O2/c1-3-5-6-9-7(8)4-2/h4H,2-3,5-6H2,1H3
InChIKey
CQEYYJKEWSMYFG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butyl Acrylate
CAS: 141-32-2
CID: 8846
Formula: C7H12O2
MW: 128.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.17
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass128.083729621
Monoisotopic Mass128.083729621
Topological Polar Surface Area26.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity97.1
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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