Cas no 328125-40-2 (4-(4-pyridazinyl)-Benzaldehyde)
328125-40-2 structure
Product Name:4-(4-pyridazinyl)-Benzaldehyde
CAS No:328125-40-2
MF:C11H8N2O
MW:184.19402217865
CID:1110908
PubChem ID:18182562
Update Time:2025-04-20
4-(4-pyridazinyl)-Benzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 4-(4-pyridazinyl)-Benzaldehyde
- 4-(4-Pyridazinyl)benzaldehyde
- SCHEMBL6211609
- 328125-40-2
- DTXSID001308239
-
- Inchi： 1S/C11H8N2O/c14-8-9-1-3-10(4-2-9)11-5-6-12-13-7-11/h1-8H
- InChI Key： FZSUPECQQXHGMS-UHFFFAOYSA-N
- SMILES： O=CC1C=CC(=CC=1)C1=CN=NC=C1
Computed Properties
- Exact Mass: 184.063662883g/mol
- Monoisotopic Mass: 184.063662883g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 188
- 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: 42.8?2
4-(4-pyridazinyl)-Benzaldehyde Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
328125-40-2 (4-(4-pyridazinyl)-Benzaldehyde) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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