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1230-36-0 | Pyran-3-ol, 2,2'-oxybis[tetrahydro-, diacetate (7CI,8CI)
CAS No: 1230-36-0 Catalog No: AG000JXF MDL No:
Product Description
Catalog Number:
AG000JXF
Chemical Name:
Pyran-3-ol, 2,2'-oxybis[tetrahydro-, diacetate (7CI,8CI)
CAS Number:
1230-36-0
Molecular Formula:
C14H26O9
Molecular Weight:
338.3508
IUPAC Name:
[2-(3-acetyloxyoxan-2-yl)oxyoxan-3-yl] acetate
InChI:
InChI=1S/C14H22O7/c1-9(15)19-11-5-3-7-17-13(11)21-14-12(20-10(2)16)6-4-8-18-14/h11-14H,3-8H2,1-2H3
InChI Key:
CTCGYDFSKYEJIU-UHFFFAOYSA-N
SMILES:
OC1CCCOC1OC1OCCCC1O.CC(=O)O.CC(=O)O
NSC Number:
53721
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.137g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.323g/mol
Monoisotopic Mass:
302.137g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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