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188915-88-0 | 1,4,7,10,13-Pentaoxacyclooctadecan-14-one
CAS No: 188915-88-0 Catalog No: AG002HJ7 MDL No:
Product Description
Catalog Number:
AG002HJ7
Chemical Name:
1,4,7,10,13-Pentaoxacyclooctadecan-14-one
CAS Number:
188915-88-0
Molecular Formula:
C13H24O6
Molecular Weight:
276.3261
IUPAC Name:
1,4,7,10,13-pentaoxacyclooctadecan-14-one
InChI:
InChI=1S/C13H24O6/c14-13-3-1-2-4-15-5-6-16-7-8-17-9-10-18-11-12-19-13/h1-12H2
InChI Key:
RZIHNXUTBJLTEB-UHFFFAOYSA-N
SMILES:
O=C1CCCCOCCOCCOCCOCCO1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.157g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.329g/mol
Monoisotopic Mass:
276.157g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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