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122444-62-6

122444-62-6 | 2-Cyclohexen-1-one, 4-ethyl-4-(2-propen-1-yl)-, (4R)-

CAS No: 122444-62-6 Catalog No: AG00178R MDL No:

Product Description

Catalog Number:
AG00178R
Chemical Name:
2-Cyclohexen-1-one, 4-ethyl-4-(2-propen-1-yl)-, (4R)-
CAS Number:
122444-62-6
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
4-ethyl-4-prop-2-enylcyclohex-2-en-1-one
InChI:
InChI=1S/C11H16O/c1-3-7-11(4-2)8-5-10(12)6-9-11/h3,5,8H,1,4,6-7,9H2,2H3
InChI Key:
WLQBXBKGVMGNKX-UHFFFAOYSA-N
SMILES:
C=CC[C@@]1(CC)CCC(=O)C=C1

Properties

Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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