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93530-08-6

93530-08-6 | Propane, 1-iodo-3-(methylthio)-

CAS No: 93530-08-6 Catalog No: AG006F98 MDL No:

Product Description

Catalog Number:
AG006F98
Chemical Name:
Propane, 1-iodo-3-(methylthio)-
CAS Number:
93530-08-6
Molecular Formula:
C4H9IS
Molecular Weight:
216.0837
IUPAC Name:
1-iodo-3-methylsulfanylpropane
InChI:
InChI=1S/C4H9IS/c1-6-4-2-3-5/h2-4H2,1H3
InChI Key:
MGMVTKAYVYCTOB-UHFFFAOYSA-N
SMILES:
CSCCCI

Properties

Complexity:
23.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.947g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.08g/mol
Monoisotopic Mass:
215.947g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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