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35954-65-5 | (3aR)-2-Methyl-5α-(acetoxymethyl)-6β,7α-diacetoxy-3aα,6,7,7aα-tetrahydro-5H-pyrano[3,2-d]oxazole
CAS No: 35954-65-5 Catalog No: AG00C9XV MDL No:
Product Description
Catalog Number:
AG00C9XV
Chemical Name:
(3aR)-2-Methyl-5α-(acetoxymethyl)-6β,7α-diacetoxy-3aα,6,7,7aα-tetrahydro-5H-pyrano[3,2-d]oxazole
CAS Number:
35954-65-5
IUPAC Name:
[(3aR,5R,6S,7R,7aR)-6,7-diacetyloxy-2-methyl-5,6,7,7a-tetrahydro-3aH-pyrano[3,2-d][1,3]oxazol-5-yl]methyl acetate
InChI:
InChI=1S/C14H19NO8/c1-6-15-11-13(22-9(4)18)12(21-8(3)17)10(5-19-7(2)16)23-14(11)20-6/h10-14H,5H2,1-4H3/t10-,11-,12-,13-,14+/m1/s1
InChI Key:
WZFQZRLQMXZMJA-KSTCHIGDSA-N
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
329.111g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.305g/mol
Monoisotopic Mass:
329.111g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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