Basic information
- CAS
19026-22-3- Standard SMILES
CC(=O)N[C@H]1C(=O)O[C@H](CO)[C@@H](O)[C@@H]1O- InChIKey
NELQYZRSPDCGRQ-DBRKOABJSA-N- Molecular formula
- C8H13NO6
- Average molar mass
- 219.19 g/mol
- Monoisotopic mass
- 219.07428713
Names & identifiers
- Preferred name
- 2-acetamido-2-deoxy-D-gluconolactone
- IUPAC
- N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxooxan-3-yl]acetamide
- English name
- 2-acetamido-2-deoxy-D-glucono-.delta.-lactone
- Molecular formula
- C8H13NO6
- Molecular weight
- 219.19192
Names & synonyms
19026-22-32-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-LACTONE09ICI1V6AX2-Acetamido-2-deoxy-D-gluconolactoneCD-801102-Acetamido-2-deoxy-D-glucono-(1,5)-lactoneDTXSID5012914452-acetamido-2-deoxy-1,5-gluconolactoneRefChem:462728GlyTouCan:G64675KVDTXCID201722035G64675KV
Show more names
Einecs 242-761-3N-AcetylglucosaMino-1,5-lactone2-acetamido-2-deoxy-D-glucono-.delta.-lactone2-Acetylamino-2-deoxy-D-gluconic acid δ-lactone2-Acetylamino-2-deoxy-D-glucopyranose-1,5-lactoneD-Gluconic acid, 2-(acetylamino)-2-deoxy-, δ-lactoneN-Acetyl-D-glucosamino-1,5-lactone, 2-Acetamido-2-deoxy-D-gluconolactone
242-761-3N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxooxan-3-yl]acetamideN-((3R,4R,5S,6R)-4,5-DIHYDROXY-6-(HYDROXYMETHYL)-2-OXOTETRAHYDRO-2H-PYRAN-3-YL)ACETAMIDE2-(acetylamido)-2-deoxy-D-glucono-1,5-lactone2-Acetamido-2-deoxy-D-glucono-1,5-lactone (>80%)N-Acetyl-D-glucosamino-1,5-lactone2xsbCD 80110
Database identifiers
Properties
Computed structural properties
- XLogP
- -2
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 268
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Melting point
- 168 · 168-170°C
- Boiling point
- 602 · 602.0±55.0 °C(Predicted)
- Density
- 1.5 · 1.50±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly), Water (Slightly, Sonicated)
- pka
- 12.25 · 12.25±0.70(Predicted)
- form
- Solid
- color
- White to Off-White
- Stability
- Hygroscopic
- CAS DataBase Reference
- 19026 · 19026-22-3
- FDA UNII
- 9 ICI1V6AX · 09ICI1V6AX
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2914390090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338-P321
Chemistry & industry
Applications
Uses2-acetamido-2-deoxy-D-glucono-.delta.-lactone is used to inhibit breakdown of products by beta-hexosaminidase(s) when the culture medium is used as an enzyme source
Suppliers21 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
杭州璟皓生物科技有限公司（原河南辛迪加生物）17513242016 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
上海艾康睿医药科技有限公司021-33730573 15821573036 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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