4-(Methylsulfonylamino)benzylamine hydrochloride - CAS 128263-66-1
Catalog: |
BB006892 |
Product Name: |
4-(Methylsulfonylamino)benzylamine hydrochloride |
CAS: |
128263-66-1 |
Synonyms: |
Methanesulfonamide, N-[4-(aminomethyl)phenyl]-, hydrochloride (1:1); Methanesulfonamide, N-[4-(aminomethyl)phenyl]-, monohydrochloride; N-[4-(Aminomethyl)phenyl]methanesulfonamide hydrochloride |
Related CAS: | 129872-50-0 (free base)
|
IUPAC Name: | N-[4-(aminomethyl)phenyl]methanesulfonamide;hydrochloride |
Molecular Weight: | 236.72 |
Molecular Formula: | C8H13ClN2O2S |
Canonical SMILES: | CS(=O)(=O)NC1=CC=C(C=C1)CN.Cl |
InChI: | InChI=1S/C8H12N2O2S.ClH/c1-13(11,12)10-8-4-2-7(6-9)3-5-8;/h2-5,10H,6,9H2,1H3;1H |
InChI Key: | LMTMMWPJYNUNSD-UHFFFAOYSA-N |
Melting Point: | >275°C (dec.) |
Purity: | 95% |
Appearance: | White Solid |
Storage: | Store at RT under inert atmosphere |
MDL: | MFCD06245516 |
LogP: | 3.17290 |
GHS Hazard Statement: | H302 (33.33%): 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 |
TW-201446767-A | Pyrrolotriazine derivative as a phospholipid inositol 3-kinase inhibitor | 20130215 |
WO-2014124757-A1 | Pyrrolotriazine derivatives as pi3k inhibitors | 20130215 |
US-2010267706-A1 | Compounds, Compositions and Methods Comprising Pyridazine Derivatives | 20090420 |
EP-1932832-B1 | Triarylcarboxylic acid derivative | 20051007 |
JP-2008537547-A | Novel compounds as vanilloid receptor antagonists, isomers thereof or pharmaceutically acceptable salts thereof, and pharmaceutical compositions containing the same | 20050319 |
Complexity: | 237 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.0386265 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.0386265 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 80.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Amines and Anilines
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