Cas no 1003575-38-9 (6-Bromo-4-isopropoxy-quinazoline)
1003575-38-9 structure
Product Name:6-Bromo-4-isopropoxy-quinazoline
CAS No:1003575-38-9
MF:C11H11BrN2O
MW:267.121841669083
CID:2145503
Update Time:2023-08-04
6-Bromo-4-isopropoxy-quinazoline Chemical and Physical Properties
Names and Identifiers
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- 6-bromo-4-isopropoxy-quinazoline
- UQSUTLZSCQKZAY-UHFFFAOYSA-N
- 6-bromo-4-(propan-2-yloxy)quinazoline
- Quinazoline, 6-bromo-4-(1-methylethoxy)-
- 6-Bromo-4-isopropoxy-quinazoline
-
- Inchi： 1S/C11H11BrN2O/c1-7(2)15-11-9-5-8(12)3-4-10(9)13-6-14-11/h3-7H,1-2H3
- InChI Key： UQSUTLZSCQKZAY-UHFFFAOYSA-N
- SMILES： BrC1C=CC2=C(C=1)C(=NC=N2)OC(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 213
- XLogP3: 3.5
- Topological Polar Surface Area: 35
6-Bromo-4-isopropoxy-quinazoline 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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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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