4-Amino-1-benzylpyrrolidin-2-one Hydrochloride - CAS 478832-05-2
Catalog: |
BB026420 |
Product Name: |
4-Amino-1-benzylpyrrolidin-2-one Hydrochloride |
CAS: |
478832-05-2 |
Synonyms: |
4-amino-1-(phenylmethyl)-2-pyrrolidinone;hydrochloride; 4-amino-1-benzylpyrrolidin-2-one;hydrochloride |
IUPAC Name: | 4-amino-1-benzylpyrrolidin-2-one;hydrochloride |
Description: | 4-Amino-1-benzylpyrrolidin-2-one Hydrochloride (CAS# 478832-05-2) is a useful research chemical. |
Molecular Weight: | 226.70 |
Molecular Formula: | C11H15ClN2O |
Canonical SMILES: | C1C(CN(C1=O)CC2=CC=CC=C2)N.Cl |
InChI: | InChI=1S/C11H14N2O.ClH/c12-10-6-11(14)13(8-10)7-9-4-2-1-3-5-9;/h1-5,10H,6-8,12H2;1H |
InChI Key: | BWOHUVMBCGXODG-UHFFFAOYSA-N |
LogP: | 2.18640 |
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, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-1403255-A1 | Rho KINASE INHIBITORS | 20010612 |
JP-WO2002100833-A1 | Rho kinase inhibitor | 20010612 |
US-2004138286-A1 | Rho kinase inhibitors | 20010612 |
US-7199147-B2 | Rho kinase inhibitors | 20010612 |
EP-1258247-A1 | Adenosine analogues for the treatment of insulin resistance syndrome and diabetes | 20010514 |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.0872908 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.0872908 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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