Home Other Building Blocks 1-(4-ethylphenyl)-3-methylbutan-1-one

1-(4-ethylphenyl)-3-methylbutan-1-one

CAS No.:
137128-80-4
Catalog Number:
AG01B9S0
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
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Product Description
Catalog Number:
AG01B9S0
Chemical Name:
1-(4-ethylphenyl)-3-methylbutan-1-one
CAS Number:
137128-80-4
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
MDL Number:
MFCD11210658
IUPAC Name:
1-(4-ethylphenyl)-3-methylbutan-1-one
InChI:
InChI=1S/C13H18O/c1-4-11-5-7-12(8-6-11)13(14)9-10(2)3/h5-8,10H,4,9H2,1-3H3
InChI Key:
VCIGKTPSWBUYFI-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)C(=O)CC(C)C
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties