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88794-75-6 | Pentane, 1-iodo-4,4-dimethoxy-
CAS No: 88794-75-6 Catalog No: AG004ATT MDL No:
Product Description
Catalog Number:
AG004ATT
Chemical Name:
Pentane, 1-iodo-4,4-dimethoxy-
CAS Number:
88794-75-6
Molecular Formula:
C7H15IO2
Molecular Weight:
258.0973
IUPAC Name:
1-iodo-4,4-dimethoxypentane
InChI:
InChI=1S/C7H15IO2/c1-7(9-2,10-3)5-4-6-8/h4-6H2,1-3H3
InChI Key:
ZOYOXEVHRXFNTB-UHFFFAOYSA-N
SMILES:
ICCCC(OC)(OC)C
Properties
Complexity:
81.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.012g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.099g/mol
Monoisotopic Mass:
258.012g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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