Cas no 72063-77-5 (4-Pyrimidinamine, 2,6-dichloro-N-propyl-)
72063-77-5 structure
Product Name:4-Pyrimidinamine, 2,6-dichloro-N-propyl-
CAS No:72063-77-5
MF:C7H9Cl2N3
MW:206.072458982468
CID:544621
PubChem ID:15338432
Update Time:2025-04-19
4-Pyrimidinamine, 2,6-dichloro-N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyrimidinamine, 2,6-dichloro-N-propyl-
- 2,6-DICHLORO-N-PROPYL-4-PYRIMIDINAMINE
- 2,6-dichloro-N-propylpyrimidin-4-amine
- 72063-77-5
- DTXSID90571714
- IANUGQINIJIROT-UHFFFAOYSA-N
- SCHEMBL15719830
- (2,6-dichloro-pyrimidin-4-yl)-n-propylamine
- 2,6-Dichloro-4-n-propylaminopyrimidine
-
- Inchi: 1S/C7H9Cl2N3/c1-2-3-10-6-4-5(8)11-7(9)12-6/h4H,2-3H2,1H3,(H,10,11,12)
- InChI Key: IANUGQINIJIROT-UHFFFAOYSA-N
- SMILES: ClC1=CC(=NC(=N1)Cl)NCCC
Computed Properties
- Exact Mass: 205.01757
- Monoisotopic Mass: 205.0173527g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 134
- 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: 3.3
- Topological Polar Surface Area: 37.8?2
Experimental Properties
- PSA: 37.81
4-Pyrimidinamine, 2,6-dichloro-N-propyl- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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