Cas no 59227-99-5 (2-Propanone, 1,1-dibromo-3-iodo-)
59227-99-5 structure
Product Name:2-Propanone, 1,1-dibromo-3-iodo-
CAS No:59227-99-5
MF:C3H3Br2IO
MW:341.767791986465
CID:339419
PubChem ID:23426733
Update Time:2025-04-19
2-Propanone, 1,1-dibromo-3-iodo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanone, 1,1-dibromo-3-iodo-
- 1,1-dibromo-3-iodopropan-2-one
- CHEBI:184490
- 1,1-Dibromo-3-iodo-2-propanone
- 1,1-Dibromo-3-iodoacetone
- DTXSID90633987
- 59227-99-5
-
- Inchi： 1S/C3H3Br2IO/c4-3(5)2(7)1-6/h3H,1H2
- InChI Key： UDPFVNCNMONXIZ-UHFFFAOYSA-N
- SMILES： ICC(C(Br)Br)=O
Computed Properties
- Exact Mass: 339.75899
- Monoisotopic Mass: 339.75954g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 73.3
- 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: 2.3
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2-Propanone, 1,1-dibromo-3-iodo- Related Literature
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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