Home Other Building Blocks 2-Butyl-2-cyclopentenone

2-Butyl-2-cyclopentenone

CAS No.:
5561-05-7
Catalog Number:
AG01EMWF
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
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Product Description
Catalog Number:
AG01EMWF
Chemical Name:
2-Butyl-2-cyclopentenone
CAS Number:
5561-05-7
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
2-butylcyclopent-2-en-1-one
InChI:
InChI=1S/C9H14O/c1-2-3-5-8-6-4-7-9(8)10/h6H,2-5,7H2,1H3
InChI Key:
LQANWSYLRLMKDX-UHFFFAOYSA-N
SMILES:
CCCCC1=CCCC1=O
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties