2-(Phenylsulfonyl)ethanamine - CAS 67215-15-0
Catalog: |
BB033215 |
Product Name: |
2-(Phenylsulfonyl)ethanamine |
CAS: |
67215-15-0 |
Synonyms: |
2-(benzenesulfonyl)ethanamine; 2-(benzenesulfonyl)ethanamine |
IUPAC Name: | 2-(benzenesulfonyl)ethanamine |
Description: | 2-(Phenylsulfonyl)ethanamine (CAS# 67215-15-0) is a useful research chemical. |
Molecular Weight: | 185.24 |
Molecular Formula: | C8H11NO2S |
Canonical SMILES: | C1=CC=C(C=C1)S(=O)(=O)CCN |
InChI: | InChI=1S/C8H11NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,6-7,9H2 |
InChI Key: | HEKKXNNVIAECAN-UHFFFAOYSA-N |
MDL: | MFCD01862554 |
LogP: | 2.20010 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021253568-A1 | Azaindole derivatives as rho-kinase inhibitors | 20180613 |
CN-107722043-B | Preparation method of chiral amino compound and intermediate thereof | 20160810 |
CN-109311839-A | Methylamine derivative is used for treating cancer as lysyl oxidase inhibitor | 20160219 |
AU-2015268962-A1 | MTH1 inhibitors for treatment of inflammatory and autoimmune conditions | 20140604 |
CA-2948601-A1 | Mth1 inhibitors for treatment of inflammatory and autoimmune conditions | 20140604 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.05104977 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.05104977 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 68.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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