Cas no 1079054-20-8 (2-chloro-4-(oxazol-5-yl)aniline)
1079054-20-8 structure
Product Name:2-chloro-4-(oxazol-5-yl)aniline
CAS No:1079054-20-8
MF:C9H7ClN2O
MW:194.61768078804
CID:1080525
PubChem ID:58293638
Update Time:2025-04-20
2-chloro-4-(oxazol-5-yl)aniline Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-4-(oxazol-5-yl)aniline
- DA-26599
- 1079054-20-8
- SCHEMBL1450203
- HGGMCQWMZHEDEP-UHFFFAOYSA-N
-
- Inchi： 1S/C9H7ClN2O/c10-7-3-6(1-2-8(7)11)9-4-12-5-13-9/h1-5H,11H2
- InChI Key： HGGMCQWMZHEDEP-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC(=C1)C1=CN=CO1)N
Computed Properties
- Exact Mass: 194.0246905g/mol
- Monoisotopic Mass: 194.0246905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 179
- 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: 1.9
- Topological Polar Surface Area: 52?2
2-chloro-4-(oxazol-5-yl)aniline Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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