Cas no 61613-42-1 (Benzoic acid, 2-[(4-hydroxy-1-naphthalenyl)carbonyl]-)
61613-42-1 structure
Product Name:Benzoic acid, 2-[(4-hydroxy-1-naphthalenyl)carbonyl]-
CAS No:61613-42-1
MF:C18H12O4
MW:292.285485267639
CID:472797
PubChem ID:71394095
Update Time:2025-04-19
Benzoic acid, 2-[(4-hydroxy-1-naphthalenyl)carbonyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-[(4-hydroxy-1-naphthalenyl)carbonyl]-
- 2-(4-hydroxynaphthalene-1-carbonyl)benzoic acid
- DTXSID30815821
- 2-(4-Hydroxy-1-naphthoyl)benzoic acid
- 61613-42-1
-
- Inchi: 1S/C18H12O4/c19-16-10-9-14(11-5-1-2-6-12(11)16)17(20)13-7-3-4-8-15(13)18(21)22/h1-10,19H,(H,21,22)
- InChI Key: CGXYGULYDZQICD-UHFFFAOYSA-N
- SMILES: OC1C=CC(C(C2C=CC=CC=2C(=O)O)=O)=C2C=CC=CC2=1
Computed Properties
- Exact Mass: 292.07356
- Monoisotopic Mass: 292.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- Complexity: 433
- 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: 3.7
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- PSA: 74.6
Benzoic acid, 2-[(4-hydroxy-1-naphthalenyl)carbonyl]- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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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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