N-(3-Iodophenyl)methanesulfonamide - CAS 180530-10-3
Catalog: |
BB013710 |
Product Name: |
N-(3-Iodophenyl)methanesulfonamide |
CAS: |
180530-10-3 |
Synonyms: |
N-(3-iodophenyl)methanesulfonamide; N-(3-iodophenyl)methanesulfonamide |
IUPAC Name: | N-(3-iodophenyl)methanesulfonamide |
Description: | N-(3-Iodophenyl)methanesulfonamide (CAS# 180530-10-3) is a useful research chemical. |
Molecular Weight: | 297.11 |
Molecular Formula: | C7H8INO2S |
Canonical SMILES: | CS(=O)(=O)NC1=CC(=CC=C1)I |
InChI: | InChI=1S/C7H8INO2S/c1-12(10,11)9-7-4-2-3-6(8)5-7/h2-5,9H,1H3 |
InChI Key: | PZMRAQUKSREUQN-UHFFFAOYSA-N |
LogP: | 2.81650 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3733670-A1 | Tetrahydropyrrole compound, preparation method therefor, pharmaceutical composition containing same, and use thereof | 20171226 |
WO-2017158388-A1 | 2-cyanoisoindoline derivatives for treating cancer | 20160318 |
EP-3429994-B1 | 2-cyanoisoindoline derivatives for treating cancer | 20160318 |
AU-2014330089-A1 | Bicyclic alkyne derivatives and uses thereof | 20131003 |
CA-2926340-A1 | Bicyclic alkyne derivatives and uses thereof | 20131003 |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 296.93205 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 296.93205 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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