Home Other Building Blocks 1-(4-methoxy-2,5-dimethylphenyl)ethan-1-one

1-(4-methoxy-2,5-dimethylphenyl)ethan-1-one

CAS No.:
104174-28-9
Catalog Number:
AG01A6BP
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
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Product Description
Catalog Number:
AG01A6BP
Chemical Name:
1-(4-methoxy-2,5-dimethylphenyl)ethan-1-one
CAS Number:
104174-28-9
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD11553435
IUPAC Name:
1-(4-methoxy-2,5-dimethylphenyl)ethanone
InChI:
InChI=1S/C11H14O2/c1-7-6-11(13-4)8(2)5-10(7)9(3)12/h5-6H,1-4H3
InChI Key:
HYYOEBPABVJBNX-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(cc1C)C(=O)C
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties