Cas no 263387-96-8 (1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester)
263387-96-8 structure
Product Name:1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester
CAS No:263387-96-8
MF:C14H11NO3
MW:241.242043733597
CID:1430467
PubChem ID:11746770
Update Time:2025-04-20
1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester
- methyl 2-methoxy-3-cyano-1-naphthoate
- methyl 3-cyano-2-methoxynaphthalene-1-carboxylate
- DB-297874
- SCHEMBL6229441
- methyl 3-cyano-2-methoxy-1-naphthoate
- FLGRJTLHLVSFHJ-UHFFFAOYSA-N
- DTXSID40471790
- 263387-96-8
-
- Inchi： 1S/C14H11NO3/c1-17-13-10(8-15)7-9-5-3-4-6-11(9)12(13)14(16)18-2/h3-7H,1-2H3
- InChI Key： FLGRJTLHLVSFHJ-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C#N)C=C2C=CC=CC2=C1C(=O)OC
Computed Properties
- Exact Mass: 241.07389321g/mol
- Monoisotopic Mass: 241.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 359
- 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: 2.7
- Topological Polar Surface Area: 59.3?2
1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester Related Literature
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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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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
263387-96-8 (1-Naphthalenecarboxylic acid, 3-cyano-2-methoxy-, methyl ester) Related Products
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