CAS
97576-09-5 Purity
96%
97576-09-5 Purity
96%
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3-O-Benzyl-beta-D-glucose
CAS
97590-76-6
Catalog Number
ACM97590766
Category
Other Products
Molecular Weight
270.278420 [g/mol]
Molecular Formula
C13H18O6
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Specification
Synonyms
3-O-BENZYL-D-GLUCOPYRANOSE, 3-O-Benzyl-beta-D-glucose, 97590-76-6, 10230-17-8, 3-O-Benzyl-beta-D-glucopyranose, EINECS 307-256-5, 5368AH, ZINC15657720, AKOS015910542, W-200666, I14-40114
IUPAC Name
(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-4-phenylmethoxyoxane-2,3,5-triol
Canonical SMILES
C1=CC=C(C=C1)COC2C(C(OC(C2O)O)CO)O
InChI Key
FYEFQDXXKFUMOJ-NJMOYASZSA-N
Boiling Point
551.986ºC at 760 mmHg
Flash Point
211.264ºC
Density
1.351g/cm³
EC Number
307-256-5
Exact Mass
270.11000
H-Bond Acceptor
6
H-Bond Donor
4
What is the molecular weight of 3-O-Benzyl-beta-D-glucose?
The molecular weight of 3-O-Benzyl-beta-D-glucose is 270.28 g/mol.
What is the IUPAC name of 3-O-Benzyl-beta-D-glucose?
The IUPAC name of 3-O-Benzyl-beta-D-glucose is (2R,3R,4S,5R,6R)-6-(hydroxymethyl)-4-phenylmethoxyoxane-2,3,5-triol.
What is the Canonical SMILES of 3-O-Benzyl-beta-D-glucose?
The Canonical SMILES of 3-O-Benzyl-beta-D-glucose is C1=CC=C(C=C1)COC2C(C(OC(C2O)O)CO)O.
How many hydrogen bond donor counts are there in 3-O-Benzyl-beta-D-glucose?
There are 4 hydrogen bond donor counts in 3-O-Benzyl-beta-D-glucose.
What is the topological polar surface area of 3-O-Benzyl-beta-D-glucose?
The topological polar surface area of 3-O-Benzyl-beta-D-glucose is 99.4 Ų.
What is the heavy atom count in 3-O-Benzyl-beta-D-glucose?
The heavy atom count in 3-O-Benzyl-beta-D-glucose is 19.
Is 3-O-Benzyl-beta-D-glucose a covalently-bonded unit?
Yes, 3-O-Benzyl-beta-D-glucose is a covalently-bonded unit.
How many defined atom stereocenter counts are there in 3-O-Benzyl-beta-D-glucose?
There are 5 defined atom stereocenter counts in 3-O-Benzyl-beta-D-glucose.
What is the InChIKey of 3-O-Benzyl-beta-D-glucose?
The InChIKey of 3-O-Benzyl-beta-D-glucose is FYEFQDXXKFUMOJ-NJMOYASZSA-N.
When was 3-O-Benzyl-beta-D-glucose last modified?
3-O-Benzyl-beta-D-glucose was last modified on 2023-12-30.
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