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18589-27-0 | Hexane, 2-iodo-
CAS No: 18589-27-0 Catalog No: AG007SSH MDL No:
Product Description
Catalog Number:
AG007SSH
Chemical Name:
Hexane, 2-iodo-
CAS Number:
18589-27-0
Molecular Formula:
C6H13I
Molecular Weight:
212.0719
IUPAC Name:
2-iodohexane
InChI:
InChI=1S/C6H13I/c1-3-4-5-6(2)7/h6H,3-5H2,1-2H3
InChI Key:
XCEDNORUDUKWGK-UHFFFAOYSA-N
SMILES:
CCCCC(I)C
EC Number:
242-428-2
Properties
Complexity:
35.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.006g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.074g/mol
Monoisotopic Mass:
212.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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