Cas no 187585-17-7 (4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)-)
187585-17-7 structure
Product Name:4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)-
CAS No:187585-17-7
MF:C18H17NO5
MW:327.331285238266
CID:115046
PubChem ID:10639895
Update Time:2025-04-18
4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
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- 4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)-
- 3-amino-2-(3,4,5-trimethoxyphenyl)chromen-4-one
- 4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)-(9CI)
- 187585-17-7
-
- Inchi： 1S/C18H17NO5/c1-21-13-8-10(9-14(22-2)18(13)23-3)17-15(19)16(20)11-6-4-5-7-12(11)24-17/h4-9H,19H2,1-3H3
- InChI Key： WJCKYWJJADBRAF-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2C(C(=C1C1C=C(C(=C(C=1)OC)OC)OC)N)=O
Computed Properties
- Exact Mass: 327.11067264g/mol
- Monoisotopic Mass: 327.11067264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 4
- Complexity: 492
- 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
- Topological Polar Surface Area: 80?2
4H-1-Benzopyran-4-one,3-amino-2-(3,4,5-trimethoxyphenyl)- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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