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88931-80-0 | 6-Undecen-5-ol, 11-iodo-5-methyl-
CAS No: 88931-80-0 Catalog No: AG008A1O MDL No:
Product Description
Catalog Number:
AG008A1O
Chemical Name:
6-Undecen-5-ol, 11-iodo-5-methyl-
CAS Number:
88931-80-0
Molecular Formula:
C12H23IO
Molecular Weight:
310.2149
IUPAC Name:
11-iodo-5-methylundec-6-en-5-ol
InChI:
InChI=1S/C12H23IO/c1-3-4-9-12(2,14)10-7-5-6-8-11-13/h7,10,14H,3-6,8-9,11H2,1-2H3
InChI Key:
QKMRJZCRLJTTSX-UHFFFAOYSA-N
SMILES:
CCCCC(C=CCCCCI)(O)C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
310.219g/mol
Monoisotopic Mass:
310.079g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.7
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