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14168-89-9 | D-Glucose, 2,3,4,5,6-penta-O-methyl-
CAS No: 14168-89-9 Catalog No: AG001GW1 MDL No:
Product Description
Catalog Number:
AG001GW1
Chemical Name:
D-Glucose, 2,3,4,5,6-penta-O-methyl-
CAS Number:
14168-89-9
Molecular Formula:
C11H22O6
Molecular Weight:
250.2888
IUPAC Name:
(2R,3S,4R,5R)-2,3,4,5,6-pentamethoxyhexanal
InChI:
InChI=1S/C11H22O6/c1-13-7-9(15-3)11(17-5)10(16-4)8(6-12)14-2/h6,8-11H,7H2,1-5H3/t8-,9+,10+,11+/m0/s1
InChI Key:
LNECIKHIUGKOEZ-LNFKQOIKSA-N
SMILES:
COC[C@H]([C@H]([C@@H]([C@H](C=O)OC)OC)OC)OC
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
250.142g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.291g/mol
Monoisotopic Mass:
250.142g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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