Basic information
- Standard SMILES
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O- InChIKey
LPTITAGPBXDDGR-LYYZXLFJSA-N- Molecular formula
- C16H22O11
- Average molar mass
- 390.34 g/mol
- Monoisotopic mass
- 390.11621152
Names & identifiers
- Preferred name
- beta-D-Galactose pentaacetate
- IUPAC
- [(2R,3S,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetate
Names & synonyms
beta-D-Galactose pentaacetate4163-60-41,2,3,4,6-Penta-O-acetyl-beta-D-galactopyranoseDTXSID20883736beta-Penta-O-acetyl-D-galactopyranose1,2,3,4,6-penta-o-acetylgalactopyranosebeta-D-Galactopyranose, 1,2,3,4,6-pentaacetateRefChem:410470DTXCID101023232224-008-0b-d-Galactose pentaacetatePenta-O-acetyl-beta-D-galactopyranose
Show more names
beta-D-Galactopyranose pentaacetate[(2R,3S,4S,5R,6S)-3,4,5,6-tetraacetyloxyoxan-2-yl]methyl acetateMFCD00063259NSC 1353(2S,3R,4S,5S,6R)-6-(acetoxymethyl)tetrahydro-2H-pyran-2,3,4,5-tetrayl tetraacetate.beta.-D-Galactopyranose, pentaacetateNSC 119334ss-D-galactose pentaacetate
Database identifiers
- CAS
4163-60-4- PubChem CID
- 94752
- DTXSID
DTXSID20883736- EC Number
- 224-008-0
- Nikkaji
- J109.350I
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 599
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
Warning
H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
.beta.-D-Galactopyranose, pentaacetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)
Chemistry & industry
Uses & manufacturing
General Manufacturing Information.beta.-D-Galactopyranose, 1,2,3,4,6-pentaacetate: ACTIVE
Related reactions
8 records
Linked notes
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