1-[4-(Aminomethyl)phenyl]-n-methylmethanesulfonamide - CAS 191868-24-3
Catalog: |
BB074653 |
Product Name: |
1-[4-(Aminomethyl)phenyl]-n-methylmethanesulfonamide |
CAS: |
191868-24-3 |
Synonyms: |
1-[4-(aminomethyl)phenyl]-N-methylmethanesulfonamide; 1-(4-(Aminomethyl)phenyl)-N-methylmethanesulfonamide; 4-(methylamino-sulphonylmethyl)benzenemethanamine |
IUPAC Name: | 1-[4-(aminomethyl)phenyl]-N-methylmethanesulfonamide |
Description: | 1-[4-(Aminomethyl)phenyl]-n-methylmethanesulfonamide |
Molecular Weight: | 214.29 |
Molecular Formula: | C9H14N2O2S |
Canonical SMILES: | CNS(=O)(=O)CC1=CC=C(C=C1)CN |
InChI: | InChI=1S/C9H14N2O2S/c1-11-14(12,13)7-9-4-2-8(6-10)3-5-9/h2-5,11H,6-7,10H2,1H3 |
InChI Key: | KXLAVAYUPDHDPM-UHFFFAOYSA-N |
Complexity: | 251 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.07759887 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.07759887 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 80.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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