Cas no 65399-09-9 (1(3H)-Isobenzofuranone, 5-(dimethylamino)-)
65399-09-9 structure
Product Name:1(3H)-Isobenzofuranone, 5-(dimethylamino)-
CAS No:65399-09-9
MF:C10H11NO2
MW:177.199842691422
CID:399505
PubChem ID:3401069
Update Time:2025-04-19
1(3H)-Isobenzofuranone, 5-(dimethylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1(3H)-Isobenzofuranone, 5-(dimethylamino)-
- 5-(dimethylamino)-3H-2-benzofuran-1-one
- 5-Dimethylaminophthalide
- NCGC00326083-01
- 5-dimethylamino-3H-isobenzofuran-1-one
- DPTAYXRMLJNOCN-UHFFFAOYSA-N
- 5-dimethylaninophthalide
- DTXSID30392147
- 65399-09-9
- 5-(Dimethylamino)isobenzofuran-1(3H)-one
- SCHEMBL3908674
- AB01321852-02
- AKOS005448593
-
- Inchi： 1S/C10H11NO2/c1-11(2)8-3-4-9-7(5-8)6-13-10(9)12/h3-5H,6H2,1-2H3
- InChI Key： DPTAYXRMLJNOCN-UHFFFAOYSA-N
- SMILES： O1C(C2C=CC(=CC=2C1)N(C)C)=O
Computed Properties
- Exact Mass: 177.07903
- Monoisotopic Mass: 177.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 215
- 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: 0.9
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
1(3H)-Isobenzofuranone, 5-(dimethylamino)- Related Literature
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Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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5. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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