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17423-43-7 | Butanoyl chloride, 2-carbonyl-
CAS No: 17423-43-7 Catalog No: AG001ZJE MDL No:
Product Description
Catalog Number:
AG001ZJE
Chemical Name:
Butanoyl chloride, 2-carbonyl-
CAS Number:
17423-43-7
Molecular Formula:
C5H5ClO2
Molecular Weight:
132.5450
IUPAC Name:
5-oxopent-4-enoyl chloride
InChI:
InChI=1S/C5H5ClO2/c6-5(8)3-1-2-4-7/h2H,1,3H2
InChI Key:
VQSUOQUUGBKIKX-UHFFFAOYSA-N
SMILES:
CCC(=C=O)C(=O)Cl
Properties
Complexity:
124
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.998g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.543g/mol
Monoisotopic Mass:
131.998g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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