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929-33-9 | Undecanoic acid, 11-iodo-, methyl ester
CAS No: 929-33-9 Catalog No: AG006K1G MDL No:
Product Description
Catalog Number:
AG006K1G
Chemical Name:
Undecanoic acid, 11-iodo-, methyl ester
CAS Number:
929-33-9
Molecular Formula:
C12H23IO2
Molecular Weight:
326.2143
IUPAC Name:
methyl 11-iodoundecanoate
InChI:
InChI=1S/C12H23IO2/c1-15-12(14)10-8-6-4-2-3-5-7-9-11-13/h2-11H2,1H3
InChI Key:
BVPACBLWIHBMNE-UHFFFAOYSA-N
SMILES:
ICCCCCCCCCCC(=O)OC
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.218g/mol
Monoisotopic Mass:
326.074g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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