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77887-93-5 | 1,4,7,10,13,16-Hexaoxacyclononadecan-18-ol, acetate
CAS No: 77887-93-5 Catalog No: AG005EIJ MDL No:
Product Description
Catalog Number:
AG005EIJ
Chemical Name:
1,4,7,10,13,16-Hexaoxacyclononadecan-18-ol, acetate
CAS Number:
77887-93-5
Molecular Formula:
C15H30O9
Molecular Weight:
354.3933
IUPAC Name:
acetic acid;1,4,7,10,13,16-hexaoxacyclononadecan-18-ol
InChI:
InChI=1S/C13H26O7.C2H4O2/c14-13-11-19-9-7-17-5-3-15-1-2-16-4-6-18-8-10-20-12-13;1-2(3)4/h13-14H,1-12H2;1H3,(H,3,4)
InChI Key:
SSGWONPFDIROAX-UHFFFAOYSA-N
SMILES:
OC1COCCOCCOCCOCCOCCOC1.CC(=O)O
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.189g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
354.396g/mol
Monoisotopic Mass:
354.189g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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