Basic information
- CAS
5094-33-7- Standard SMILES
Nc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1- InChIKey
MIAKOEWBCMPCQR-UHFFFAOYSA-N- Molecular formula
- C12H17NO6
- Average molar mass
- 271.27 g/mol
Names & identifiers
- Preferred name
- (2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
- IUPAC
- 2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
- English name
- 4-Aminophenyl-beta-D-galactopyranoside
- Molecular formula
- C12H17NO6
- Molecular weight
- 271.27
Names & synonyms
(2R,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol4-AMINOPHENYL-BETA-D-GALACTOPYRANOSIDE4-Aminophenyl ?-D-Galactopyranoside2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triolp-aminophenyl-hexopyranosideSCHEMBL4760031p-Aminophenyl b-D-glucopyranoside(2S,3R,4S,5R,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol4-Aminophenyl-b-D-galactopyranosideNSC87909NSC-87909AKOS032947929
Show more names
PAPG(2S,3R,4S,5R,6R)-2-(4-Aminophenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triolPAP2LPP1LLP1aPLPP1PAPOLGPAP-2aNSC 87909-D<
SB49600LS-14107SR-01000883736SR-01000883736-12-(4-aminophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol4-Aminophenyl beta-D-galactopyranoside, beta-galactosidase substrate
Database identifiers
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
Physicochemical properties
- Melting point
- 163 °C · 163 °C
- Boiling point
- 556 ℃ · 556℃
- Density
- 1.517 · 1.517
- refractive index
- -39.5 ° · -39.5 ° (C=1, H2O)
- Flash point
- 290 ℃ · 290℃
- storage temp.
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- solubility
- 49 · water: 49.00-51.00 mg/mL, clear, colorless to yellow
- pka
- 12.93 · 12.93±0.70(Predicted)
- form
- powder
- color
- white to yellow cast
- biological source
- rabbit
- optical activity
- -42 to · [α]/D -42.00 to -34.00°, c =9.00-11.00 mg/mL in water
- Water Solubility
- 49 · water: 49.00-51.00mg/mL, clear, colorless to yellow
- InChI
- InChI=1/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9+,10+,11-,12-/s3
- InChIKey
- MIAKOEWBCMPCQR-YBXAARCKSA-N
Safety & regulation
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 29400090
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS09
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H318-H411
- Precautionary statements
- P273-P280-P305+P351+P338-P310-P391-P501
Chemistry & industry
Applications
Uses4-Aminophenyl β-D-galactopyranoside (PAPG, 4-APG) is used as a substrate for the development of β-galactosidase(s) (GUS)-dependent assay systems via the formation of an electroactive product. It may be used to create affinity matricies for the capture or purification of β-galactosidase(s).
Suppliers96 total
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海康恩博科技有限公司（科小研试剂）400-1388-521 17673770086 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
Henan Rane Chemical Co., Ltd.+86-18738066252 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
Related reactions
1 records
Compound notes
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