Basic information
- CAS
31302-52-0- Standard SMILES
Nc1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1- InChIKey
MIAKOEWBCMPCQR-IIRVCBMXSA-N- Molecular formula
- C12H17NO6
- Average molar mass
- 271.27 g/mol
- Monoisotopic mass
- 271.10558726
Names & identifiers
- Preferred name
- P-Aminophenyl-Alpha-D-Galactopyranoside
- IUPAC
- (2R,3R,4S,5R,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
- English name
- 4-Aminophenyl-alpha-D-glucopyranoside
- Molecular formula
- C12H17NO6
- Molecular weight
- 271.27
Names & synonyms
P-AMINOPHENYL-ALPHA-D-GALACTOPYRANOSIDE31302-52-0(2R,3R,4S,5R,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triolDTXSID90332185RefChem:169277DTXCID402832794-Aminophenyl a-D-glucopyranoside3398-86-54-Aminophenyl alpha-D-galactopyranoside4-Aminophenyl alpha-D-glucopyranoside(2R,3R,4S,5R,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol1efi
Show more names
Paph-alpha-d-glc4-Aminophenyla-D-glucopyranosidep-Aminophenyl α-D-glucopyranoside4-Aminophenyl α-D-Glucopyranosideα-D-Glucopyranoside, 4-aminophenylalpha-D-Glucopyranoside p-aminophenylalpha-D-Glucopyranoside 4-aminophenylp-aminophenyl-alpha-D-glucopyranoside4-Aminophenyl-alpha-D-glucopyranoside(2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
4'-aminophenyl-alpha-d-galactopyranosideSCHEMBL869389AKOS030255052DB03242NS00070108H85842Q27460634
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 283
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Melting point
- 185 · 185-186℃
- Boiling point
- 556 ℃ · 556℃
- Density
- 1.517 · 1.517
- Flash point
- 290 ℃ · 290℃
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly, Heated, Sonicated)
- form
- Solid
- pka
- 12.929 · 12.929±0.70(predicted)
- color
- Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2940000080
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses4-Aminophenyl α-D-Glucopyranoside is a glycoside derivative of 4-Aminophenol (A618920); a nephrotoxic metabolite of Acetaminophen (A161220) and Phenacetin (P294580) (1).
Suppliers31 total
临沂锎源化学科技有限公司13188735557 · [email protected]
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [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]
梯希爱（上海）化工贸易有限公司021-61109150 · [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]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
杭州东帆化学有限公司86-0571-85151182
上海汇凯化学科技有限公司021-61995394 18916691159 · [email protected]
武汉开诺医药科技有限公司18040571231/1402788087
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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