Name: Name:α-D-Glucopyranoside, 4-nitrophenyl, 2,3,4,6-tetraacetate
Brand: Angene
SKU: AG001G79
Rating: 90 (10 reviews)

α-D-Glucopyranoside, 4-nitrophenyl, 2,3,4,6-tetraacetate

CAS No.:

14131-42-1

Catalog Number:

AG001G79

Molecular Formula:

C20H23NO12

Molecular Weight:

469.3961

Catalog Number:

AG001G79

Chemical Name:

α-D-Glucopyranoside, 4-nitrophenyl, 2,3,4,6-tetraacetate

CAS Number:

14131-42-1

Molecular Formula:

C20H23NO12

Molecular Weight:

469.3961

MDL Number:

MFCD04973639

IUPAC Name:

[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(4-nitrophenoxy)oxan-2-yl]methyl acetate

InChI:

InChI=1S/C20H23NO12/c1-10(22)28-9-16-17(29-11(2)23)18(30-12(3)24)19(31-13(4)25)20(33-16)32-15-7-5-14(6-8-15)21(26)27/h5-8,16-20H,9H2,1-4H3/t16-,17-,18+,19-,20+/m1/s1

InChI Key:

BEUISCKWILNFIL-OBKDMQGPSA-N

SMILES:

CC(=O)OC[C@H]1O[C@H](Oc2ccc(cc2)[N+](=O)[O-])[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

Complexity:

742

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

469.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

469.399g/mol

Monoisotopic Mass:

469.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

170A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2