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1117-32-4 | Octane, 4-iodo-
CAS No: 1117-32-4 Catalog No: AG0078X0 MDL No:
Product Description
Catalog Number:
AG0078X0
Chemical Name:
Octane, 4-iodo-
CAS Number:
1117-32-4
Molecular Formula:
C8H17I
Molecular Weight:
240.1250
IUPAC Name:
4-iodooctane
InChI:
InChI=1S/C8H17I/c1-3-5-7-8(9)6-4-2/h8H,3-7H2,1-2H3
InChI Key:
RZONQKSTULVBKR-UHFFFAOYSA-N
SMILES:
CCCCC(CCC)I
Properties
Complexity:
52.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.037g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.128g/mol
Monoisotopic Mass:
240.037g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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