Cas no 915402-37-8 (3-Chloro-5-(trifluoromethoxy)-4-aminophenylboronic acid pinacol ester)
915402-37-8 structure
Product Name:3-Chloro-5-(trifluoromethoxy)-4-aminophenylboronic acid pinacol ester
CAS No:915402-37-8
MF:C9H7F3N4
MW:228.173891305923
CID:69494
PubChem ID:15152353
Update Time:2025-04-18
3-Chloro-5-(trifluoromethoxy)-4-aminophenylboronic acid pinacol ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Chloro-5-(trifluoromethoxy)-4-aminophenylboronic acid pinacol ester
- 2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethoxy)benzenamine
- 8-(Trifluoromethyl)-2,4-quinazolinediamine
- 8-Trifluoromethyl-quinazoline-2,4-diamine
- 8-(Trifluoromethyl)quinazoline-2,4(1H,3H)-diimine
- 8-Trifluoromethylquinazoline-2,4-diamine
- DTXSID60919669
- 915402-37-8
- 8-(trifluoromethyl)quinazoline-2,4-diamine
- 139337-63-6
-
- Inchi： 1S/C9H7F3N4/c10-9(11,12)5-3-1-2-4-6(5)15-8(14)16-7(4)13/h1-3H,(H4,13,14,15,16)
- InChI Key： YPYGGVLOGCJLKW-UHFFFAOYSA-N
- SMILES： FC(C1=CC=CC2=C(N)N=C(N)N=C21)(F)F
Computed Properties
- Exact Mass: 228.06228073g/mol
- Monoisotopic Mass: 228.06228073g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 258
- 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: 77.8?2
Experimental Properties
- Density: 1.31
3-Chloro-5-(trifluoromethoxy)-4-aminophenylboronic acid pinacol ester Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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