Cas no 99307-44-5 (2,3-Dihydro-5-methoxy-6-methyl-7--1-oxo-4(1H)-isoindolcarbonsaeure)
99307-44-5 structure
Product Name:2,3-Dihydro-5-methoxy-6-methyl-7--1-oxo-4(1H)-isoindolcarbonsaeure
CAS No:99307-44-5
MF:C16H19NO5
MW:305.325764894485
CID:2025477
PubChem ID:122706792
Update Time:2025-04-21
2,3-Dihydro-5-methoxy-6-methyl-7--1-oxo-4(1H)-isoindolcarbonsaeure Chemical and Physical Properties
Names and Identifiers
-
- 2,3-Dihydro-5-methoxy-6-methyl-7--1-oxo-4(1H)-isoindolcarbonsaeure
- 2,3-Dihydro-5-methoxy-6-methyl-7-[(3-methyl-2-butenyl)oxy]-1-oxo-4(1H)-isoindolcarbonsaeure
- Duricaulic acid
- 6LUU9T79QN
- 5-Methoxy-6-methyl-7-(3-methylbut-2-enoxy)-1-oxo-isoindoline-4-carboxylic acid
- 1H-Isoindole-4-carboxylic acid, 2,3-dihydro-5-methoxy-6-methyl-7-((3-methyl-2-buten-1-yl)oxy)-1-oxo-
- UNII-6LUU9T79QN
- 99307-44-5
- 5-methoxy-6-methyl-7-(3-methylbut-2-enoxy)-1-oxo-2,3-dihydroisoindole-4-carboxylic acid
-
- Inchi： 1S/C16H19NO5/c1-8(2)5-6-22-14-9(3)13(21-4)12(16(19)20)10-7-17-15(18)11(10)14/h5H,6-7H2,1-4H3,(H,17,18)(H,19,20)
- InChI Key： UPZZADAGKYWUKG-UHFFFAOYSA-N
- SMILES： O(C/C=C(\C)/C)C1=C(C)C(=C(C(=O)O)C2CNC(C=21)=O)OC
Computed Properties
- Exact Mass: 305.12632271g/mol
- Monoisotopic Mass: 305.12632271g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 471
- 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: 2.1
- Topological Polar Surface Area: 84.9?2
2,3-Dihydro-5-methoxy-6-methyl-7--1-oxo-4(1H)-isoindolcarbonsaeure Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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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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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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