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Home > Nitro Compounds > 85668-54-8
85668-54-8 | 3,4-dinitrophenyl-beta-galactopyranoside
CAS No: 85668-54-8 Catalog No: AG00GPXX MDL No:
Product Description
Catalog Number:
AG00GPXX
Chemical Name:
3,4-dinitrophenyl-beta-galactopyranoside
CAS Number:
85668-54-8
IUPAC Name:
(2S,3R,4S,5R,6R)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C12H14N2O10/c15-4-8-9(16)10(17)11(18)12(24-8)23-5-1-2-6(13(19)20)7(3-5)14(21)22/h1-3,8-12,15-18H,4H2/t8-,9+,10+,11-,12-/m1/s1
InChI Key:
AXPKTIFWSNCTCQ-YBXAARCKSA-N
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
346.065g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
346.248g/mol
Monoisotopic Mass:
346.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
191A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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