2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL ISOTHIOCYANATE

CAS No.
132413-50-4
CCD No.
CCD00047529
Formula
C35 H27 N O9 S
MolWeight
637.662

Basic Information

Product Name: 2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL ISOTHIOCYANATE
CAS: 132413-50-4
English Synonyms: BGITC ; BGIT ; 2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL ISOTHIOCYANATE
MDL Number.: MFCD00075064
H bond acceptor: 10
H bond donor: 0
Smile: c1ccc(cc1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)N=C=S)OC(=O)c3ccccc3)OC(=O)c4ccccc4)OC(=O)c5ccccc5
InChi: InChI=1S/C35H27NO9S/c37-32(23-13-5-1-6-14-23)41-21-27-28(43-33(38)24-15-7-2-8-16-24)29(44-34(39)25-17-9-3-10-18-25)30(31(42-27)36-22-46)45-35(40)26-19-11-4-12-20-26/h1-20,27-31H,21H2/t27-,28-,29+,30-,31-/m1/s1
InChiKey: InChIKey=RITGYQZMPNVVEG-PXPWAULYSA-N

Property

Melting Point: 150-152 DEG C(LIT)
Comments: OPTICAL ACTIVITY: [ALPHA]25/D +29 DEG, C = 1 IN CHLOROFORM
UNSPSC: 12352100
WGK: 3

Safety information

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