Cas no 61704-36-7 (2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)-)
61704-36-7 structure
Product Name:2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)-
CAS No:61704-36-7
MF:C12H8ClNO
MW:217.651021957397
CID:469338
PubChem ID:12367085
Update Time:2025-04-19
2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)-
- 4-(3-chlorophenyl)pyridine-2-carbaldehyde
- 4-(3-Chlorophenyl)picolinaldehyde
- DTXSID10494577
- starbld0020915
- 61704-36-7
-
- Inchi： 1S/C12H8ClNO/c13-11-3-1-2-9(6-11)10-4-5-14-12(7-10)8-15/h1-8H
- InChI Key： TUTFQRYSQGTIEA-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1)C1C=CN=C(C=O)C=1
Computed Properties
- Exact Mass: 217.02954
- Monoisotopic Mass: 217.0294416g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 222
- 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: 2.9
- Topological Polar Surface Area: 30?2
Experimental Properties
- PSA: 29.96
2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)- Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
61704-36-7 (2-Pyridinecarboxaldehyde, 4-(3-chlorophenyl)-) Related Products
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- 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)
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