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138452-63-8 | 2,4,6,8,10-Undecanepentol
CAS No: 138452-63-8 Catalog No: AG00196B MDL No:
Product Description
Catalog Number:
AG00196B
Chemical Name:
2,4,6,8,10-Undecanepentol
CAS Number:
138452-63-8
Molecular Formula:
C11H24O5
Molecular Weight:
236.3053
IUPAC Name:
undecane-2,4,6,8,10-pentol
InChI:
InChI=1S/C11H24O5/c1-7(12)3-9(14)5-11(16)6-10(15)4-8(2)13/h7-16H,3-6H2,1-2H3
InChI Key:
CXFLNXBOQOUAMD-UHFFFAOYSA-N
SMILES:
OC(CC(CC(O)C)O)CC(CC(O)C)O
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
236.308g/mol
Monoisotopic Mass:
236.162g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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