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295-42-1 | 1,3,6,9,12-Pentaoxacyclotetradecane
CAS No: 295-42-1 Catalog No: AG002YLE MDL No:
Product Description
Catalog Number:
AG002YLE
Chemical Name:
1,3,6,9,12-Pentaoxacyclotetradecane
CAS Number:
295-42-1
Molecular Formula:
C9H18O5
Molecular Weight:
206.2362
IUPAC Name:
1,3,6,9,12-pentaoxacyclotetradecane
InChI:
InChI=1S/C9H18O5/c1-3-11-5-7-13-9-14-8-6-12-4-2-10-1/h1-9H2
InChI Key:
VWZHQAUGSQDVLY-UHFFFAOYSA-N
SMILES:
O1CCOCCOCCOCCOC1
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.238g/mol
Monoisotopic Mass:
206.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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