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31294-95-8 | Pentane, 2-iodo-2-methyl-
CAS No: 31294-95-8 Catalog No: AG007HRN MDL No:
Product Description
Catalog Number:
AG007HRN
Chemical Name:
Pentane, 2-iodo-2-methyl-
CAS Number:
31294-95-8
Molecular Formula:
C6H13I
Molecular Weight:
212.0719
IUPAC Name:
2-iodo-2-methylpentane
InChI:
InChI=1S/C6H13I/c1-4-5-6(2,3)7/h4-5H2,1-3H3
InChI Key:
KCNIMEJTKUGMLA-UHFFFAOYSA-N
SMILES:
CCCC(I)(C)C
Properties
Complexity:
48.1
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:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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