Basic information
- CAS
22153-71-5- Standard SMILES
C[C@@H]1O[C@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](O)[C@H](O)[C@@H]1O- InChIKey
YILIDCGSXCGACV-NFOQIUCISA-N- Molecular formula
- C12H15NO7
- Average molar mass
- 285.25 g/mol
- Monoisotopic mass
- 285.08485182
Overview
4-nitrophenyl beta-L-fucoside is a beta-L-fucoside that is beta-L-fucopyranose in which the anomeric hydroxy hydrogen is replaced by a 4-nitrophenyl group. It has a role as a chromogenic compound. It is a C-nitro compound and a beta-L-fucoside. It is functionally related to a 4-nitrophenol.
Names & identifiers
- Preferred name
- 4-Nitrophenyl 6-deoxy-beta-L-galactopyranoside
- IUPAC
- (2S,3S,4R,5S,6R)-2-methyl-6-(4-nitrophenoxy)oxane-3,4,5-triol
- English name
- 4-Nitrophenyl-beta-L-fucopyranoside
- Molecular formula
- C12H15NO7
- Molecular weight
- 285.25
Names & synonyms
22153-71-5p-Nitrophenyl 6-deoxy-beta-L-galactopyranoside4-nitrophenyl 6-deoxy-beta-L-galactopyranosideDTXSID001262940RefChem:1071304DTXCID401693618244-808-34-NITROPHENYL-BETA-L-FUCOPYRANOSIDE4-Nitrophenyl beta-L-fucopyranoside4-Nitrophenyl b-L-fucopyranosidep-nitrophenyl beta-L-fucopyranoside(2S,3S,4R,5S,6R)-2-methyl-6-(4-nitrophenoxy)oxane-3,4,5-triol
Show more names
PNP-β-L-FucPNP-BETA-L-FUCPNP BETA-L-FUCOPYRANOSIDE4-NITROPHENYL-B-L-FUCOSIDEP-NITROPHENYL-BETA-L-FUCOSIDE4-NITROPHENYL-BETA-L-FUCOSIDE4-NITROPHENYL-B-L-FUCOPYRANOSIDEP-nitrophenyl-B-L-fucopyranoside4-Nitrophenyl β-L-fucopyranoside
MFCD000636994-nitrophenyl beta-L-fucoside(2S,3S,4R,5S,6R)-2-Methyl-6-(4-nitrophenoxy)tetrahydro-2H-pyran-3,4,5-triol4-Nitrophenyl |A-L-FucopyranosideEINECS 244-808-3BATE-L-Galactopyranoside,4-nitrophenyl 6-deoxy-p-nitrophenyl beta-l-fucosideorb2940954
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- Boiling point
- 515.4 · 515.4±50.0 °C(Predicted)
- Density
- 1.503 · 1.503±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 12.68 · 12.68±0.70(Predicted)
- InChI
- InChI=1/C12H15NO7/c1-6-9(14)10(15)11(16)12(19-6)20-8-4-2-7(3-5-8)13(17)18/h2-6,9-12,14-16H,1H3/t6-,9+,10+,11-,12+/s3
- InChIKey
- YILIDCGSXCGACV-UAQQRRQCNA-N
- SMILES
- [C@@H]1(O[C@H]([C@@H](O)[C@@H](O)[C@@H]1O)C)OC1=CC=C([N+]([O-])=O)C=C1 |&1:0,2,3,5,7,r|
- CAS DataBase Reference
- 22153 · 22153-71-5(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-P264b-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362+P364-P403+P233-P501c
- WGK Germany
- 3 · 3
- HS Code
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
- wgk
- 3
- hs_code
- 29400090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P261-P264b-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362+P364-P403+P233-P501c
Chemistry & industry
Applications
Uses4-Nitrophenyl beta-L-Fucopyranoside is a chromogenic substrate for β-D-Fucosidase, producing a yellow solution upon cleavage.
Suppliers48 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [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]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
杭州东帆化学有限公司86-0571-85151182
北京伊诺凯科技有限公司15652467323 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
Related reactions
1 records
Compound notes
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