N-Benzylidene-p-toluenesulfonamide - CAS 13707-41-0
Catalog: |
BB008506 |
Product Name: |
N-Benzylidene-p-toluenesulfonamide |
CAS: |
13707-41-0 |
Synonyms: |
N-benzylidene-4-methylbenzenesulfonamide |
IUPAC Name: | (NE)-N-benzylidene-4-methylbenzenesulfonamide |
Description: | N-Benzylidene-p-toluenesulfonamide (CAS# 13707-41-0 ) is a useful research chemical. |
Molecular Weight: | 259.32 |
Molecular Formula: | C14H13NO2S |
Canonical SMILES: | CC1=CC=C(C=C1)S(=O)(=O)N=CC2=CC=CC=C2 |
InChI: | InChI=1S/C14H13NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-11H,1H3 |
InChI Key: | HVCKVBQOKOFBFH-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 3.88360 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021163493-A1 | Compounds, compositions, and methods for modulating calcium ion homeostasis | 20200212 |
CN-110066231-B | Aza beta-substituted Morita-Baylis-Hillman type compound and synthetic method thereof | 20190524 |
TW-202035391-A | Compound, process for preparation of compounds, use of the compounds, pharmaceuticalcomposition, compound for use as a medicament, and compound for use as a medicament for the treatment of pain | 20181031 |
CN-113260614-A | Piperazinyl and piperidinyl quinazolin-4 (3H) -one derivatives active against pain | 20181031 |
US-2020002362-A1 | Difluoromethyl and difluoromethylene transfer reagents | 20180629 |
PMID | Publication Date | Title | Journal |
19191701 | 20090211 | Green and efficient synthesis of sulfonamides catalyzed by nano-Ru/Fe(3)O(4) | Journal of the American Chemical Society |
12688780 | 20030418 | Imino ene reaction catalyzed by ytterbium(III) triflate and TMSCl or TMSOTf | The Journal of organic chemistry |
12492324 | 20021227 | Asymmetric synthesis of anti- and syn-beta-amino alcohols by reductive cross-coupling of transition metal-coordinated planar chiral arylaldehydes with aldimines | The Journal of organic chemistry |
11869140 | 20020307 | Asymmetric synthesis of beta-amino alcohols by reductive cross-coupling of benzylideneamine with planar chiral benzaldehydes | Organic letters |
12240358 | 20010921 | Lewis base effects in the Baylis-Hillman reaction of imines with cyclohex-2-en-1-one and cyclopent-2-en-1-one | Chemical communications (Cambridge, England) |
Complexity: | 369 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.06669983 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.06669983 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 54.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 1 |
XLogP3: | 3.2 |
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