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201596-42-1 | 1-iodo-3-(propan-2-yloxy)propan-2-ol
CAS No: 201596-42-1 Catalog No: AG019ZQ4 MDL No:MFCD20414825
Product Description
Catalog Number:
AG019ZQ4
Chemical Name:
1-iodo-3-(propan-2-yloxy)propan-2-ol
CAS Number:
201596-42-1
Molecular Formula:
C6H13IO2
Molecular Weight:
244.0707
MDL Number:
MFCD20414825
IUPAC Name:
1-iodo-3-propan-2-yloxypropan-2-ol
InChI:
InChI=1S/C6H13IO2/c1-5(2)9-4-6(8)3-7/h5-6,8H,3-4H2,1-2H3
InChI Key:
SVJUEFKXTHJJEN-UHFFFAOYSA-N
SMILES:
ICC(COC(C)C)O
Properties
Complexity:
66.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.996g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.072g/mol
Monoisotopic Mass:
243.996g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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