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100256-35-7 | Ethanone, 1-(4-methoxy-3-propylphenyl)-
CAS No: 100256-35-7 Catalog No: AG0001E3 MDL No:
Product Description
Catalog Number:
AG0001E3
Chemical Name:
Ethanone, 1-(4-methoxy-3-propylphenyl)-
CAS Number:
100256-35-7
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
IUPAC Name:
1-(4-methoxy-3-propylphenyl)ethanone
InChI:
InChI=1S/C12H16O2/c1-4-5-11-8-10(9(2)13)6-7-12(11)14-3/h6-8H,4-5H2,1-3H3
InChI Key:
SCLUPMQCUCAMRO-UHFFFAOYSA-N
SMILES:
CCCc1cc(ccc1OC)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:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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