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18086-25-4 | Acetophenone, 2-(2,5-dimethoxyphenyl)-2',4'-dihydroxy- (8CI)
CAS No: 18086-25-4 Catalog No: AG0022F0 MDL No:
Product Description
Catalog Number:
AG0022F0
Chemical Name:
Acetophenone, 2-(2,5-dimethoxyphenyl)-2',4'-dihydroxy- (8CI)
CAS Number:
18086-25-4
Molecular Formula:
C16H16O5
Molecular Weight:
288.2952
IUPAC Name:
1-(2,4-dihydroxyphenyl)-2-(2,5-dimethoxyphenyl)ethanone
InChI:
InChI=1S/C16H16O5/c1-20-12-4-6-16(21-2)10(7-12)8-14(18)13-5-3-11(17)9-15(13)19/h3-7,9,17,19H,8H2,1-2H3
InChI Key:
REMBKOKSZWCKDJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1CC(=O)c1ccc(cc1O)O)OC
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.1g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.299g/mol
Monoisotopic Mass:
288.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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