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Home > Other Building Blocks > 140430-69-9
140430-69-9 | 1-Propanone, 2-hydroxy-2-methyl-1-(3-propylphenyl)-
CAS No: 140430-69-9 Catalog No: AG001CFR MDL No:
Product Description
Catalog Number:
AG001CFR
Chemical Name:
1-Propanone, 2-hydroxy-2-methyl-1-(3-propylphenyl)-
CAS Number:
140430-69-9
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
IUPAC Name:
2-hydroxy-2-methyl-1-(3-propylphenyl)propan-1-one
InChI:
InChI=1S/C13H18O2/c1-4-6-10-7-5-8-11(9-10)12(14)13(2,3)15/h5,7-9,15H,4,6H2,1-3H3
InChI Key:
JFDROEZYFJUJON-UHFFFAOYSA-N
SMILES:
CCCc1cccc(c1)C(=O)C(O)(C)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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