Home Other Building Blocks β-D-Glucopyranoside, 5-methyl-2-(1-methylethyl)phenyl

β-D-Glucopyranoside, 5-methyl-2-(1-methylethyl)phenyl

CAS No.:
20772-23-0
Catalog Number:
AG002J7Q
Molecular Formula:
C16H24O6
Molecular Weight:
312.3582
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG002J7Q
Chemical Name:
β-D-Glucopyranoside, 5-methyl-2-(1-methylethyl)phenyl
CAS Number:
20772-23-0
Molecular Formula:
C16H24O6
Molecular Weight:
312.3582
MDL Number:
MFCD00080959
IUPAC Name:
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(5-methyl-2-propan-2-ylphenoxy)oxane-3,4,5-triol
InChI:
InChI=1S/C16H24O6/c1-8(2)10-5-4-9(3)6-11(10)21-16-15(20)14(19)13(18)12(7-17)22-16/h4-6,8,12-20H,7H2,1-3H3/t12-,13-,14+,15-,16-/m1/s1
InChI Key:
GKQGIQVSMCHAFX-IBEHDNSVSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2cc(C)ccc2C(C)C)[C@@H]([C@H]([C@@H]1O)O)O
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
312.157g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
312.362g/mol
Monoisotopic Mass:
312.157g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties