Cas no 74316-59-9 (5-Quinolinecarbonitrile, 8-(bromomethyl)-)
74316-59-9 structure
Product Name:5-Quinolinecarbonitrile, 8-(bromomethyl)-
CAS No:74316-59-9
MF:C11H7BrN2
MW:247.090681314468
CID:541208
PubChem ID:12950801
Update Time:2025-04-19
5-Quinolinecarbonitrile, 8-(bromomethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 5-Quinolinecarbonitrile, 8-(bromomethyl)-
- 8-(bromomethyl)-5-Quinolinecarbonitrile
- 8-(bromomethyl)quinoline-5-carbonitrile
- DTXSID90513750
- SCHEMBL3530022
- FT-0727753
- 74316-59-9
- 5-cyano-8-bromomethylquinoline
-
- Inchi： 1S/C11H7BrN2/c12-6-8-3-4-9(7-13)10-2-1-5-14-11(8)10/h1-5H,6H2
- InChI Key： QWLKBFXIPPZNKJ-UHFFFAOYSA-N
- SMILES： BrCC1=CC=C(C#N)C2=CC=CN=C21
Computed Properties
- Exact Mass: 245.97926g/mol
- Monoisotopic Mass: 245.97926g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 245
- 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: 2.5
- Topological Polar Surface Area: 36.7?2
5-Quinolinecarbonitrile, 8-(bromomethyl)- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
74316-59-9 (5-Quinolinecarbonitrile, 8-(bromomethyl)-) Related Products
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