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53170-93-7 | 3,4'-DIHYDROXYPROPIOPHENONE
CAS No: 53170-93-7 Catalog No: AG003IFC MDL No:MFCD24688528
Product Description
Catalog Number:
AG003IFC
Chemical Name:
3,4'-DIHYDROXYPROPIOPHENONE
CAS Number:
53170-93-7
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD24688528
IUPAC Name:
3-hydroxy-1-(4-hydroxyphenyl)propan-1-one
InChI:
InChI=1S/C9H10O3/c10-6-5-9(12)7-1-3-8(11)4-2-7/h1-4,10-11H,5-6H2
InChI Key:
LTEPZFZSPZASKJ-UHFFFAOYSA-N
SMILES:
OCCC(=O)c1ccc(cc1)O
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Phenolic compounds from the branches of Eucalyptus maideni. | Chemistry & biodiversity 20120101 |
| Phenolic compounds in ectomycorrhizal interaction of lignin modified silver birch. | BMC plant biology 20090101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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