Cas no 1211534-07-4 (2-(tert-Butyl)-5-chloronicotinaldehyde)
1211534-07-4 structure
Product Name:2-(tert-Butyl)-5-chloronicotinaldehyde
CAS No:1211534-07-4
MF:C10H12ClNO
MW:197.661381721497
CID:1091060
PubChem ID:71302605
Update Time:2025-04-20
2-(tert-Butyl)-5-chloronicotinaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 2-(tert-Butyl)-5-chloronicotinaldehyde
- 2-tert-butyl-5-chloronicotinaldehyde
- 2-tert-butyl-5-chloropyridine-3-carbaldehyde
- 1211534-07-4
- DB-203545
- A849858
-
- Inchi： 1S/C10H12ClNO/c1-10(2,3)9-7(6-13)4-8(11)5-12-9/h4-6H,1-3H3
- InChI Key： PLUYYEMQMSUADB-UHFFFAOYSA-N
- SMILES： ClC1=CN=C(C(C=O)=C1)C(C)(C)C
Computed Properties
- Exact Mass: 197.0607417g/mol
- Monoisotopic Mass: 197.0607417g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- 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: 2.6
- Topological Polar Surface Area: 30?2
2-(tert-Butyl)-5-chloronicotinaldehyde 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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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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