Home Other Building Blocks 2-ETHYLCYCLOHEX-2-EN-1-ONE

2-ETHYLCYCLOHEX-2-EN-1-ONE

CAS No.:
31863-60-2
Catalog Number:
AG01DZ9X
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
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Product Description
Catalog Number:
AG01DZ9X
Chemical Name:
2-ETHYLCYCLOHEX-2-EN-1-ONE
CAS Number:
31863-60-2
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD24687977
IUPAC Name:
2-ethylcyclohex-2-en-1-one
InChI:
InChI=1S/C8H12O/c1-2-7-5-3-4-6-8(7)9/h5H,2-4,6H2,1H3
InChI Key:
AHAATKOSNXIXCX-UHFFFAOYSA-N
SMILES:
CCC1=CCCCC1=O
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties