Home Other Building Blocks β-D-Glucopyranoside, methyl 1-thio-

β-D-Glucopyranoside, methyl 1-thio-

CAS No.:
30760-09-9
Catalog Number:
AG00317D
Molecular Formula:
C7H14O5S
Molecular Weight:
210.2481
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Product Description
Catalog Number:
AG00317D
Chemical Name:
β-D-Glucopyranoside, methyl 1-thio-
CAS Number:
30760-09-9
Molecular Formula:
C7H14O5S
Molecular Weight:
210.2481
MDL Number:
MFCD00798404
IUPAC Name:
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-methylsulfanyloxane-3,4,5-triol
InChI:
InChI=1S/C7H14O5S/c1-13-7-6(11)5(10)4(9)3(2-8)12-7/h3-11H,2H2,1H3/t3-,4-,5+,6-,7+/m1/s1
InChI Key:
LZFNFLTVAMOOPJ-ZFYZTMLRSA-N
SMILES:
CS[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
210.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
210.244g/mol
Monoisotopic Mass:
210.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties