Cas no 18256-48-9 (acetophenone, 2,4'-dihydroxy-3'-methoxy-)
18256-48-9 structure
Product Name:acetophenone, 2,4'-dihydroxy-3'-methoxy-
acetophenone, 2,4'-dihydroxy-3'-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- acetophenone, 2,4'-dihydroxy-3'-methoxy-
- 2-hydroxy-1-(4-hydroxy-3-methoxyphenyl)ethanone
- Ethanone, 2-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-
- Phenol, 4-hydroxyacetyl-2-methoxy-
- alpha,4-Dihydroxy-3-methoxyacetophenone
- 2-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)ethanone #
- CHEBI:208387
- 2,4'-Dihydroxy-3'-methoxyacetophenone
- NSC526464
- SCHEMBL1491848
- 4-08-00-02739 (Beilstein Handbook Reference)
- NSC-526464
- BRN 2259722
- QNMANLUEFQNQCX-UHFFFAOYSA-N
- alpha-Hydroxyacetoguaiacone
- DTXSID00171305
- 18256-48-9
- NSC 526464
- alpha-Hydroxyacetovanillone
- CHEMBL592620
-
- Inchi： 1S/C9H10O4/c1-13-9-4-6(8(12)5-10)2-3-7(9)11/h2-4,10-11H,5H2,1H3
- InChI Key： QNMANLUEFQNQCX-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C=CC(C(CO)=O)=C1)O
Computed Properties
- Exact Mass: 182.0579
- Monoisotopic Mass: 182.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 181
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.1
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.76
- LogP: 0.57580
acetophenone, 2,4'-dihydroxy-3'-methoxy- Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
18256-48-9 (acetophenone, 2,4'-dihydroxy-3'-methoxy-) Related Products
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