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89556-60-5

89556-60-5 | 1-Propanone, 1-(2,5-dimethoxyphenyl)-2-methyl-

CAS No: 89556-60-5 Catalog No: AG003YCN MDL No:

Product Description

Catalog Number:
AG003YCN
Chemical Name:
1-Propanone, 1-(2,5-dimethoxyphenyl)-2-methyl-
CAS Number:
89556-60-5
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
IUPAC Name:
1-(2,5-dimethoxyphenyl)-2-methylpropan-1-one
InChI:
InChI=1S/C12H16O3/c1-8(2)12(13)10-7-9(14-3)5-6-11(10)15-4/h5-8H,1-4H3
InChI Key:
XUAJROAIHNSLOO-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)C(C)C)OC

Properties

Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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