Cas no 68716-07-4 (1-Naphthalenol, 4-methoxy-, acetate)
68716-07-4 structure
Product Name:1-Naphthalenol, 4-methoxy-, acetate
CAS No:68716-07-4
MF:C13H12O3
MW:216.232583999634
CID:392676
PubChem ID:12523733
Update Time:2025-04-19
1-Naphthalenol, 4-methoxy-, acetate Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenol, 4-methoxy-, acetate
- (4-methoxynaphthalen-1-yl) acetate
- 1-METHOXYNAPHTHALEN-4-YL ACETATE
- 1-acetoxy-4-methoxy-naphthalene
- 1-Acetoxy-4-methoxy-naphthalin
- 4-acetoxy-1-methoxynaphthalene
- 4-methoxynaphthalen-1-yl acetate
- Acetoxy-4-methoxynaphthalene
- 1-Methoxy-4-acetoxy-naphthalin
- 1 -Acetoxy-4-methoxynaphthalene
- A836222
- 68716-07-4
- SCHEMBL9195639
- acetic acid (4-methoxy-1-naphthalenyl) ester
- ZKJGSANFMVMFTI-UHFFFAOYSA-N
- AMY7802
- DTXSID20501281
- 1-Acetoxy-4-methoxynaphthalene
-
- Inchi： 1S/C13H12O3/c1-9(14)16-13-8-7-12(15-2)10-5-3-4-6-11(10)13/h3-8H,1-2H3
- InChI Key： ZKJGSANFMVMFTI-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C1C=CC(=C2C=CC=CC2=1)OC
Computed Properties
- Exact Mass: 216.07900
- Monoisotopic Mass: 216.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 252
- 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: 2.8
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53000
- LogP: 2.77370
1-Naphthalenol, 4-methoxy-, acetate Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
68716-07-4 (1-Naphthalenol, 4-methoxy-, acetate) Related Products
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