4-Amino-1-methanesulfonylpiperidine - CAS 402927-97-3
Catalog: |
BB024433 |
Product Name: |
4-Amino-1-methanesulfonylpiperidine |
CAS: |
402927-97-3 |
Synonyms: |
1-methylsulfonyl-4-piperidinamine; 1-methylsulfonylpiperidin-4-amine |
IUPAC Name: | 1-methylsulfonylpiperidin-4-amine |
Description: | 4-Amino-1-methanesulfonylpiperidine (CAS# 402927-97-3) is a useful research chemical for organic synthesis and in the preparation of pharmaceutical compositions. |
Molecular Weight: | 178.25 |
Molecular Formula: | C6H14N2O2S |
Canonical SMILES: | CS(=O)(=O)N1CCC(CC1)N |
InChI: | InChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-6(7)3-5-8/h6H,2-5,7H2,1H3 |
InChI Key: | FLQSRSQNICPZIH-UHFFFAOYSA-N |
Boiling Point: | 296 °C at 760 mmHg |
Density: | 1.27 g/cm3 |
LogP: | 1.08810 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113200983-A | Compound with pyrrolopyridine structure, preparation method and medical application | 20210522 |
WO-2021170076-A1 | Compounds as cdk2/4/6 inhibitors | 20200228 |
WO-2021127499-A1 | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20191218 |
WO-2021084765-A1 | 4-aminobut-2-enamide derivatives and salts thereof | 20191031 |
WO-2021085653-A1 | 4-aminobut-2-enamide derivatives and salts thereof | 20191031 |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.07759887 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.07759887 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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