Cas no 139342-11-3 (1-(6-bromopyridin-2-yl)propan-1-ol)
139342-11-3 structure
Product Name:1-(6-bromopyridin-2-yl)propan-1-ol
CAS No:139342-11-3
MF:C8H10BrNO
MW:216.07510137558
CID:2120287
PubChem ID:15668519
Update Time:2025-04-21
1-(6-bromopyridin-2-yl)propan-1-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-(6-bromopyridin-2-yl)propan-1-ol
- 139342-11-3
- SCHEMBL9992323
- DA-10818
- URUWUNGOKOVELO-UHFFFAOYSA-N
-
- Inchi： 1S/C8H10BrNO/c1-2-7(11)6-4-3-5-8(9)10-6/h3-5,7,11H,2H2,1H3
- InChI Key： URUWUNGOKOVELO-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(C(CC)O)=N1
Computed Properties
- Exact Mass: 214.99500
- Monoisotopic Mass: 214.99458Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 121
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 33.1?2
Experimental Properties
- PSA: 33.12000
- LogP: 2.28750
1-(6-bromopyridin-2-yl)propan-1-ol Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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