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1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione
PRICE INQUIRYCatalog Number
ACM29976827
Product Name
1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione
Structure
![{[CurrentData.Name]}](https://resource.alfachemic.com/structure/29976-82-7.gif)
CAS
29976-82-7
Synonyms
DS-11578; I14-46254; 1-(2-Hydroxy-5-methylphenyl)-3-phenyl-1,3-propanedione; SR-01000209761-1; ZINC100015384; Oprea1_306488; DTXSID80353081; AC1Q5DEM; 1-(2-Hydroxy-5-methylphenyl)-3-phenyl-1,3-propanedione, 97%; KS-00000LRU;
IUPAC Name
1-(2-hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione;
Molecular Weight
254.285g/mol
Molecular Formula
C16H14O3;
Canonical SMILES
CC1=CC(=C(C=C1)O)C(=O)CC(=O)C2=CC=CC=C2;
InChI
InChI=1S/C16H14O3/c1-11-7-8-14(17)13(9-11)16(19)10-15(18)12-5-3-2-4-6-12/h2-9,17H,10H2,1H3;
InChI Key
OKAQJPKEOQHKKY-UHFFFAOYSA-N;
Complexity
331
Covalently-Bonded Unit Count
1
Exact Mass
254.094g/mol
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
19
Monoisotopic Mass
254.094g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
54.4A^2
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