Name: Name:β-D-Glucopyranoside, 3-nitrophenyl
Brand: Angene
SKU: AG002JNT
Rating: 90 (10 reviews)

β-D-Glucopyranoside, 3-nitrophenyl

CAS No.:

20838-44-2

Catalog Number:

AG002JNT

Molecular Formula:

C12H15NO8

Molecular Weight:

301.2494

Catalog Number:

AG002JNT

Chemical Name:

β-D-Glucopyranoside, 3-nitrophenyl

CAS Number:

20838-44-2

Molecular Formula:

C12H15NO8

Molecular Weight:

301.2494

MDL Number:

MFCD00067359

IUPAC Name:

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(3-nitrophenoxy)oxane-3,4,5-triol

InChI:

InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1

InChI Key:

VCCMGHVCRFMITI-RMPHRYRLSA-N

SMILES:

OC[C@H]1O[C@@H](Oc2cccc(c2)[N+](=O)[O-])[C@@H]([C@H]([C@@H]1O)O)O

EC Number:

244-074-4

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.251g/mol

Monoisotopic Mass:

301.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

145A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.5