Cas no 91498-79-2 (2-Naphthalenecarboxylic acid, 6-chloro-4-Methoxy-)
91498-79-2 structure
Product Name:2-Naphthalenecarboxylic acid, 6-chloro-4-Methoxy-
CAS No:91498-79-2
MF:C12H9ClO3
MW:236.651062726974
CID:832354
PubChem ID:73013855
Update Time:2025-04-19
2-Naphthalenecarboxylic acid, 6-chloro-4-Methoxy- Chemical and Physical Properties
Names and Identifiers
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- 2-Naphthalenecarboxylic acid, 6-chloro-4-Methoxy-
- 6-CHLORO-4-METHOXY-2-NAPHTHALENECARBOXYLIC ACID
- 6-Chloro-4-methoxy-2-naphthoic acid
- 91498-79-2
-
- Inchi： 1S/C12H9ClO3/c1-16-11-5-8(12(14)15)4-7-2-3-9(13)6-10(7)11/h2-6H,1H3,(H,14,15)
- InChI Key： NQMYQFGMONRSET-UHFFFAOYSA-N
- SMILES： ClC1C=CC2=CC(C(=O)O)=CC(=C2C=1)OC
Computed Properties
- Exact Mass: 236.0240218g/mol
- Monoisotopic Mass: 236.0240218g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 269
- 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: 3.6
- Topological Polar Surface Area: 46.5?2
2-Naphthalenecarboxylic acid, 6-chloro-4-Methoxy- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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