Cas no 1647114-77-9 (6-Bromo-7-methoxyquinazoline)
6-Bromo-7-methoxyquinazoline structure
Product Name:6-Bromo-7-methoxyquinazoline
CAS No:1647114-77-9
MF:C9H7BrN2O
MW:239.068681001663
CID:6933425
PubChem ID:91511576
Update Time:2025-05-08
6-Bromo-7-methoxyquinazoline Chemical and Physical Properties
Names and Identifiers
-
- UDHSWGVPTLIGSE-UHFFFAOYSA-N
- SCHEMBL16431603
- 6-bromo-7-methoxyquinazoline
- 1647114-77-9
- DB-169865
- 6-Bromo-7-methoxyquinazoline
-
- Inchi： 1S/C9H7BrN2O/c1-13-9-3-8-6(2-7(9)10)4-11-5-12-8/h2-5H,1H3
- InChI Key： UDHSWGVPTLIGSE-UHFFFAOYSA-N
- SMILES： BrC1=CC2=CN=CN=C2C=C1OC
Computed Properties
- Exact Mass: 237.97418Da
- Monoisotopic Mass: 237.97418Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- 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: 2.2
- Topological Polar Surface Area: 35?2
6-Bromo-7-methoxyquinazoline Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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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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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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