Cas no 84647-13-2 (Benzoic acid, 4-methyl-, 2-naphthalenyl ester)
84647-13-2 structure
Product Name:Benzoic acid, 4-methyl-, 2-naphthalenyl ester
CAS No:84647-13-2
MF:C18H14O2
MW:262.302565097809
CID:1826779
PubChem ID:532510
Update Time:2025-04-21
Benzoic acid, 4-methyl-, 2-naphthalenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 4-methyl-, 2-naphthalenyl ester
- naphthalen-2-yl 4-methylbenzoate
- DTXSID40336350
- AKOS003503018
- AN-652/11903675
- 84647-13-2
- 2-naphthyl p-methylbenzoate
- p-Toluylic acid, 2-naphthyl ester
- SCHEMBL10627535
- YFQGMYOMLGSYSX-UHFFFAOYSA-N
- p-Toluic acid, 2-naphthyl ester
- 2-naphthyl 4-methylbenzoate
-
- Inchi： 1S/C18H14O2/c1-13-6-8-15(9-7-13)18(19)20-17-11-10-14-4-2-3-5-16(14)12-17/h2-12H,1H3
- InChI Key： YFQGMYOMLGSYSX-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC(C)=CC=1)=O)C1=CC=C2C=CC=CC2=C1
Computed Properties
- Exact Mass: 262.099379685g/mol
- Monoisotopic Mass: 262.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 330
- 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: 4.8
- Topological Polar Surface Area: 26.3?2
Benzoic acid, 4-methyl-, 2-naphthalenyl ester Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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