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6196-80-1 | 1-IODO-4-METHYLPENTANE
CAS No: 6196-80-1 Catalog No: AG00EDG2 MDL No:
Product Description
Catalog Number:
AG00EDG2
Chemical Name:
1-IODO-4-METHYLPENTANE
CAS Number:
6196-80-1
IUPAC Name:
1-iodo-4-methylpentane
InChI:
InChI=1S/C6H13I/c1-6(2)4-3-5-7/h6H,3-5H2,1-2H3
InChI Key:
KHNRCDHEOHOYFY-UHFFFAOYSA-N
Properties
Complexity:
33.2
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Literature
| Title | Journal |
|---|---|
| Isomerization and decomposition reactions in the pyrolysis of branched hydrocarbons: 4-methyl-1-pentyl radical. | The journal of physical chemistry. A 20080731 |
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