Cas no 1196151-17-3 (4-chloro-2,6-dimethylpyrimidine-5-carbonitrile)
1196151-17-3 structure
Product Name:4-chloro-2,6-dimethylpyrimidine-5-carbonitrile
CAS No:1196151-17-3
MF:C7H6ClN3
MW:167.595639705658
CID:2616432
PubChem ID:55250352
Update Time:2025-04-21
4-chloro-2,6-dimethylpyrimidine-5-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-chloro-2,6-dimethylpyrimidine-5-carbonitrile
- AKOS006273944
- 1196151-17-3
- AB06107
- DTXSID601249447
- 4-Chloro-2,6-dimethyl-5-pyrimidinecarbonitrile
-
- Inchi: 1S/C7H6ClN3/c1-4-6(3-9)7(8)11-5(2)10-4/h1-2H3
- InChI Key: LNXQVYJSIURADC-UHFFFAOYSA-N
- SMILES: ClC1=C(C#N)C(C)=NC(C)=N1
Computed Properties
- Exact Mass: 167.0250249Da
- Monoisotopic Mass: 167.0250249Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 185
- 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: 1.7
- Topological Polar Surface Area: 49.6?2
4-chloro-2,6-dimethylpyrimidine-5-carbonitrile Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
1196151-17-3 (4-chloro-2,6-dimethylpyrimidine-5-carbonitrile) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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