2-(5-Methylthiophen-2-yl)pyrrolidine Hydrochloride - CAS 1256482-77-5
Catalog: |
BB060327 |
Product Name: |
2-(5-Methylthiophen-2-yl)pyrrolidine Hydrochloride |
CAS: |
1256482-77-5 |
Synonyms: |
2-(5-methylthiophen-2-yl)pyrrolidine hydrochloride; 2-(5-METHYL-2-THIENYL)PYRROLIDINE HCL; 2-(5-Methyl-2-thienyl)pyrrolidine hydrochloride; 2-(5-methylthiophen-2-yl)pyrrolidine; hydrochloride |
IUPAC Name: | 2-(5-methylthiophen-2-yl)pyrrolidinehydrochloride |
Description: | 2-(5-Methylthiophen-2-yl)pyrrolidine Hydrochloride can be used as BACE2 inhibitors to treat diabetes. |
Molecular Weight: | 203.73 + (36.46) |
Molecular Formula: | C9H13NS·HCl |
Canonical SMILES: | CC1=CC=C(S1)C2CCCN2.Cl |
InChI: | InChI=1S/C9H13NS.ClH/c1-7-4-5-9(11-7)8-3-2-6-10-8/h4-5,8,10H,2-3,6H2,1H31H |
InChI Key: | MOGHVXZOBPPSOP-UHFFFAOYSA-N |
References: | Mauser, H., et.al. U.S. Pat. Appl. Publ. US 20120053200 A1, 46, (2012). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.0535483 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.0535483 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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