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77887-88-8 | 1,4,7,10-Tetraoxacyclotridecan-12-ol
CAS No: 77887-88-8 Catalog No: AG005EQN MDL No:
Product Description
Catalog Number:
AG005EQN
Chemical Name:
1,4,7,10-Tetraoxacyclotridecan-12-ol
CAS Number:
77887-88-8
Molecular Formula:
C9H18O5
Molecular Weight:
206.2362
IUPAC Name:
1,4,7,10-tetraoxacyclotridecan-12-ol
InChI:
InChI=1S/C9H18O5/c10-9-7-13-5-3-11-1-2-12-4-6-14-8-9/h9-10H,1-8H2
InChI Key:
SYSOZAATGIIPOQ-UHFFFAOYSA-N
SMILES:
OC1COCCOCCOCCOC1
EC Number:
278-783-5
Properties
Complexity:
116
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:
1
Isotope Atom Count:
0
Molecular Weight:
206.238g/mol
Monoisotopic Mass:
206.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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