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30719-18-7

30719-18-7 | 3-iodobutan-2-one

CAS No: 30719-18-7 Catalog No: AG00BUMS MDL No:

Product Description

Catalog Number:
AG00BUMS
Chemical Name:
3-iodobutan-2-one
CAS Number:
30719-18-7
IUPAC Name:
3-iodobutan-2-one
InChI:
InChI=1S/C4H7IO/c1-3(5)4(2)6/h3H,1-2H3
InChI Key:
FPEIUGALYUCCPS-UHFFFAOYSA-N

Properties

Complexity:
60.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.954g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.003g/mol
Monoisotopic Mass:
197.954g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Literature

Title Journal
[Determination of trace iodide in drinking water in Shanghai by two columns and gas chromatography with electron capture detection]. Zhonghua yu fang yi xue za zhi [Chinese journal of preventive medicine] 20100701

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