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Home > Nitro Compounds > 74595-62-3
74595-62-3 | methyl 2,4-di-O-acetyl-3-deoxy-3-C-methyl-3-nitro-beta-D-xylopyranoside
CAS No: 74595-62-3 Catalog No: AG00FX16 MDL No:
Product Description
Catalog Number:
AG00FX16
Chemical Name:
methyl 2,4-di-O-acetyl-3-deoxy-3-C-methyl-3-nitro-beta-D-xylopyranoside
CAS Number:
74595-62-3
IUPAC Name:
[(3S,4S,5R,6R)-5-acetyloxy-6-methoxy-4-methyl-4-nitrooxan-3-yl] acetate
InChI:
InChI=1S/C11H17NO8/c1-6(13)19-8-5-18-10(17-4)9(20-7(2)14)11(8,3)12(15)16/h8-10H,5H2,1-4H3/t8-,9+,10-,11+/m1/s1
InChI Key:
QWPUFLUZODDGIW-YTWAJWBKSA-N
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
291.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.256g/mol
Monoisotopic Mass:
291.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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