Home Halogens a-D-Glucopyranose, 2,3,4,6-tetrabenzoate1-(2,2,2-trichloroethanimidate)

a-D-Glucopyranose, 2,3,4,6-tetrabenzoate1-(2,2,2-trichloroethanimidate)

CAS No.:
149707-75-5
Catalog Number:
AG01DQ0N
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DQ0N
Chemical Name:
a-D-Glucopyranose, 2,3,4,6-tetrabenzoate1-(2,2,2-trichloroethanimidate)
CAS Number:
149707-75-5
MDL Number:
MFCD19980840
IUPAC Name:
[(2R,3R,4S,5R)-3,4,5-tribenzoyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl benzoate
InChI:
InChI=1S/C36H28Cl3NO10/c37-36(38,39)35(40)50-34-29(49-33(44)25-19-11-4-12-20-25)28(48-32(43)24-17-9-3-10-18-24)27(47-31(42)23-15-7-2-8-16-23)26(46-34)21-45-30(41)22-13-5-1-6-14-22/h1-20,26-29,34,40H,21H2/t26-,27-,28+,29-,34?/m1/s1
InChI Key:
KTHFOWIANASXOK-RIKJQNKOSA-N
Properties
Complexity:
1170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
739.078g/mol
Formal Charge:
0
Heavy Atom Count:
50  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
740.967g/mol
Monoisotopic Mass:
739.078g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
148A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
9.2  
Literature
Title Journal
Large-scale preparation of the phytoalexin elicitor glucohexatose and its application as a green pesticide. Journal of agricultural and food chemistry 20030212
Properties