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1809-04-7 | Octane, 2-iodo-, (2S)-
CAS No: 1809-04-7 Catalog No: AG0022FQ MDL No:
Product Description
Catalog Number:
AG0022FQ
Chemical Name:
Octane, 2-iodo-, (2S)-
CAS Number:
1809-04-7
Molecular Formula:
C8H17I
Molecular Weight:
240.1250
IUPAC Name:
(2S)-2-iodooctane
InChI:
InChI=1S/C8H17I/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3/t8-/m0/s1
InChI Key:
XFLOGTUFKZCFTK-QMMMGPOBSA-N
SMILES:
CCCCCC[C@@H](I)C
UNII:
J837MGR6RR
Properties
Complexity:
52.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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