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85482-63-9 | 1,3,5,7,10-Pentaoxacyclododecane
CAS No: 85482-63-9 Catalog No: AG004JQL MDL No:
Product Description
Catalog Number:
AG004JQL
Chemical Name:
1,3,5,7,10-Pentaoxacyclododecane
CAS Number:
85482-63-9
Molecular Formula:
C7H14O5
Molecular Weight:
178.1831
IUPAC Name:
1,3,5,7,10-pentaoxacyclododecane
InChI:
InChI=1S/C7H14O5/c1-3-9-5-11-7-12-6-10-4-2-8-1/h1-7H2
InChI Key:
UHWQXUPPGOXGPN-UHFFFAOYSA-N
SMILES:
C1OCOCCOCCOCO1
Properties
Complexity:
87.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.184g/mol
Monoisotopic Mass:
178.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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