Cas no 920509-48-4 (6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one)
920509-48-4 structure
Product Name:6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one
CAS No:920509-48-4
MF:C14H15Cl2N3O
MW:312.194401025772
CID:756502
Update Time:2023-08-03
6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one Chemical and Physical Properties
Names and Identifiers
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- 3(2H)-Pyridazinone,6-[(4-amino-2,6-dichlorophenyl)methyl]-4-(1-methylethyl)-
- OXAZWPBCFXICCS-UHFFFAOYSA-N
- 6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-pyridazin-3-one
- 6-(4-amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one
- 6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one
-
- Inchi： 1S/C14H15Cl2N3O/c1-7(2)10-5-9(18-19-14(10)20)6-11-12(15)3-8(17)4-13(11)16/h3-5,7H,6,17H2,1-2H3,(H,19,20)
- InChI Key： OXAZWPBCFXICCS-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1CC1C=C(C(NN=1)=O)C(C)C)Cl)N
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 436
- Topological Polar Surface Area: 67.5
6-(4-Amino-2,6-dichloro-benzyl)-4-isopropyl-2H-pyridazin-3-one Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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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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