Home Other Building Blocks 1-(2-methoxy-5-methylphenyl)propan-1-one

1-(2-methoxy-5-methylphenyl)propan-1-one

CAS No.:
82620-73-3
Catalog Number:
AG01A4E4
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
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Product Description
Catalog Number:
AG01A4E4
Chemical Name:
1-(2-methoxy-5-methylphenyl)propan-1-one
CAS Number:
82620-73-3
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD09891209
IUPAC Name:
1-(2-methoxy-5-methylphenyl)propan-1-one
InChI:
InChI=1S/C11H14O2/c1-4-10(12)9-7-8(2)5-6-11(9)13-3/h5-7H,4H2,1-3H3
InChI Key:
HXJFDGOJFTWPIR-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cc(C)ccc1OC
Properties
Complexity:
177  
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:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties