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5910-25-8 | 3-Phenyl-2,4-pentanedione
CAS No: 5910-25-8 Catalog No: AG003JVC MDL No:MFCD00048223
Product Description
Catalog Number:
AG003JVC
Chemical Name:
3-Phenyl-2,4-pentanedione
CAS Number:
5910-25-8
MDL Number:
MFCD00048223
IUPAC Name:
3-phenylpentane-2,4-dione
InChI:
InChI=1S/C11H12O2/c1-8(12)11(9(2)13)10-6-4-3-5-7-10/h3-7,11H,1-2H3
InChI Key:
YIWTXSVNRCWBAC-UHFFFAOYSA-N
NSC Number:
31900
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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