Name: Name:2-(4-Methoxybenzylidene)imino-2-deoxy-1,3,4,6-Tetra-O-acetyl-β-D-glucopyranose
Brand: Angene
SKU: AG008OX4
Rating: 90 (10 reviews)

2-(4-Methoxybenzylidene)imino-2-deoxy-1,3,4,6-Tetra-O-acetyl-β-D-glucopyranose

CAS No.:

7597-81-1

Catalog Number:

AG008OX4

Molecular Formula:

C22H27NO10

Molecular Weight:

465.4505

Catalog Number:

AG008OX4

Chemical Name:

2-(4-Methoxybenzylidene)imino-2-deoxy-1,3,4,6-Tetra-O-acetyl-β-D-glucopyranose

CAS Number:

7597-81-1

Molecular Formula:

C22H27NO10

Molecular Weight:

465.4505

MDL Number:

MFCD00228913

IUPAC Name:

[3,4,6-triacetyloxy-5-[(4-methoxyphenyl)methylideneamino]oxan-2-yl]methyl acetate

InChI:

InChI=1S/C22H27NO10/c1-12(24)29-11-18-20(30-13(2)25)21(31-14(3)26)19(22(33-18)32-15(4)27)23-10-16-6-8-17(28-5)9-7-16/h6-10,18-22H,11H2,1-5H3

InChI Key:

BPVDJXUNJWJXMH-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)/C=N/[C@@H]1[C@H](OC(=O)C)OC([C@H](C1OC(=O)C)OC(=O)C)COC(=O)C

Complexity:

731

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

465.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

465.455g/mol

Monoisotopic Mass:

465.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

136A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1