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Home > Nitro Compounds > 93302-92-2
93302-92-2 | BETA-D-MANNOPYRANOSYL NITROMETHANE
CAS No: 93302-92-2 Catalog No: AG00GYGC MDL No:
Product Description
Catalog Number:
AG00GYGC
Chemical Name:
BETA-D-MANNOPYRANOSYL NITROMETHANE
CAS Number:
93302-92-2
IUPAC Name:
(2R,3S,4R,5S,6S)-2-(hydroxymethyl)-6-(nitromethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C7H13NO7/c9-2-4-6(11)7(12)5(10)3(15-4)1-8(13)14/h3-7,9-12H,1-2H2/t3-,4+,5+,6+,7+/m0/s1
InChI Key:
CNILFIXWGGSLAQ-CQOGJGKDSA-N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
223.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
223.181g/mol
Monoisotopic Mass:
223.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
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