(S)-Glycidyl 3-Nitrobenzenesulfonate - CAS 115314-14-2
Catalog: |
BB003543 |
Product Name: |
(S)-Glycidyl 3-Nitrobenzenesulfonate |
CAS: |
115314-14-2 |
Synonyms: |
3-nitrobenzenesulfonic acid [(2S)-2-oxiranyl]methyl ester; [(2S)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate |
Ordering Information
Catalog |
Size |
Price |
Stock |
BB003543 |
100 g |
$199 |
In stock |
IUPAC Name: | [(2S)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate |
Description: | (S)-Glycidyl 3-Nitrobenzenesulfonate (CAS# 115314-14-2) is a compound useful in organic synthesis. |
Molecular Weight: | 259.24 |
Molecular Formula: | C9H9NO6S |
Canonical SMILES: | C1C(O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C9H9NO6S/c11-10(12)7-2-1-3-9(4-7)17(13,14)16-6-8-5-15-8/h1-4,8H,5-6H2/t8-/m0/s1 |
InChI Key: | AIHIHVZYAAMDPM-QMMMGPOBSA-N |
Boiling Point: | 432.2 ℃ at 760 mmHg |
Density: | 1.527 g/cm3 |
Appearance: | Off-white to yellow-brown powder |
Storage: | Inert atmosphere, 2-8 ℃ |
MDL: | MFCD00064582 |
LogP: | 2.30290 |
GHS Hazard Statement: | H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021127404-A1 | Tricyclic pyridones and pyrimidones | 20191220 |
US-2021130342-A1 | Pyridazinones as parp7 inhibitors | 20191030 |
WO-2021087025-A1 | Pyridazinones as parp7 inhibitors | 20191030 |
US-2020306209-A1 | Method of treating acid-base disorders | 20190327 |
US-2020340982-A1 | Photoaffinity probes | 20190320 |
PMID | Publication Date | Title | Journal |
17961850 | 20080301 | Synthesis and preliminary evaluation of (S)-[11C]-exaprolol, a novel beta-adrenoceptor ligand for PET | Neurochemistry international |
15787468 | 20050330 | Chiral trialkanolamine-based hemicryptophanes: synthesis and oxovanadium complex | Organic letters |
Complexity: | 383 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.01505818 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.01505818 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 110 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS