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101009-64-7 | 1,6,19,24-Tetraoxacyclohexatriaconta-3,21-diene-2,5,20,23-tetrone
CAS No: 101009-64-7 Catalog No: AG0003HX MDL No:
Product Description
Catalog Number:
AG0003HX
Chemical Name:
1,6,19,24-Tetraoxacyclohexatriaconta-3,21-diene-2,5,20,23-tetrone
CAS Number:
101009-64-7
Molecular Formula:
C32H52O8
Molecular Weight:
564.7505
IUPAC Name:
1,6,19,24-tetraoxacyclohexatriaconta-3,21-diene-2,5,20,23-tetrone
InChI:
InChI=1S/C32H52O8/c33-29-21-22-31(35)39-27-19-15-11-7-3-4-8-12-16-20-28-40-32(36)24-23-30(34)38-26-18-14-10-6-2-1-5-9-13-17-25-37-29/h21-24H,1-20,25-28H2
InChI Key:
CLTSMROKRPZNQP-UHFFFAOYSA-N
SMILES:
O=C1OCCCCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCCCCOC(=O)C=C1
Properties
Complexity:
621
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
564.366g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
564.76g/mol
Monoisotopic Mass:
564.366g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
9.3
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