Cas no 848440-15-3 (4-(3-chloro-2-fluoroanilino)-6,7-dihydroxyquinazoline)
848440-15-3 structure
Product Name:4-(3-chloro-2-fluoroanilino)-6,7-dihydroxyquinazoline
CAS No:848440-15-3
MF:C14H9ClFN3O2
MW:305.691565275192
CID:2142777
PubChem ID:135975660
Update Time:2025-04-21
4-(3-chloro-2-fluoroanilino)-6,7-dihydroxyquinazoline Chemical and Physical Properties
Names and Identifiers
-
- 4-(3-chloro-2-fluoroanilino)-6,7-dihydroxyquinazoline
- 4-(3-chloro-2-fluoroanilino)-6-hydroxy-1H-quinazolin-7-one
- 848440-15-3
- DTXSID10727913
- DB-304983
- 4-[(3-CHLORO-2-FLUOROPHENYL)AMINO]QUINAZOLINE-6,7-DIOL
- 4-((3-Chloro-2-fluorophenyl)amino)quinazoline-6,7-diol
- SCHEMBL13604777
- 4-(3-Chloro-2-fluoroanilino)-6-hydroxyquinazolin-7(1H)-one
-
- Inchi： 1S/C14H9ClFN3O2/c15-8-2-1-3-9(13(8)16)19-14-7-4-11(20)12(21)5-10(7)17-6-18-14/h1-6,20-21H,(H,17,18,19)
- InChI Key： MAHMVNIYVAYDOD-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1F)NC1C2C=C(C(=CC=2N=CN=1)O)O
Computed Properties
- Exact Mass: 305.0367324Da
- Monoisotopic Mass: 305.0367324Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 365
- 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: 3.4
- Topological Polar Surface Area: 78.3?2
4-(3-chloro-2-fluoroanilino)-6,7-dihydroxyquinazoline Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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