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88208-19-9 | 1-Butanol, 1,3-diethoxy-4-iodo-
CAS No: 88208-19-9 Catalog No: AG004C1J MDL No:
Product Description
Catalog Number:
AG004C1J
Chemical Name:
1-Butanol, 1,3-diethoxy-4-iodo-
CAS Number:
88208-19-9
Molecular Formula:
C8H17IO3
Molecular Weight:
288.1232
IUPAC Name:
1,3-diethoxy-4-iodobutan-1-ol
InChI:
InChI=1S/C8H17IO3/c1-3-11-7(6-9)5-8(10)12-4-2/h7-8,10H,3-6H2,1-2H3
InChI Key:
RGJMJRLFTLWISA-UHFFFAOYSA-N
SMILES:
CCOC(CC(OCC)CI)O
Properties
Complexity:
100
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.125g/mol
Monoisotopic Mass:
288.022g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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