Home Other Building Blocks 1-(4-methylphenyl)propane-1,2-dione

1-(4-methylphenyl)propane-1,2-dione

CAS No.:
1855-08-9
Catalog Number:
AG01BUOB
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
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Product Description
Catalog Number:
AG01BUOB
Chemical Name:
1-(4-methylphenyl)propane-1,2-dione
CAS Number:
1855-08-9
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD19347215
IUPAC Name:
1-(4-methylphenyl)propane-1,2-dione
InChI:
InChI=1S/C10H10O2/c1-7-3-5-9(6-4-7)10(12)8(2)11/h3-6H,1-2H3
InChI Key:
QIFQXJRJVNMFLR-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)C(=O)C
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties