(S)-1-[(R)-1-Phenylethyl]-3-(hydroxymethyl)pyrrolidine - CAS 109960-55-6
Catalog: |
BB002572 |
Product Name: |
(S)-1-[(R)-1-Phenylethyl]-3-(hydroxymethyl)pyrrolidine |
CAS: |
109960-55-6 |
Synonyms: |
[(3S)-1-[(1R)-1-phenylethyl]-3-pyrrolidinyl]methanol; [(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methanol |
IUPAC Name: | [(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methanol |
Description: | (S)-1-[(R)-1-Phenylethyl]-3-(hydroxymethyl)pyrrolidine (CAS# 109960-55-6) is a useful research chemical. |
Molecular Weight: | 205.30 |
Molecular Formula: | C13H19NO |
Canonical SMILES: | CC(C1=CC=CC=C1)N2CCC(C2)CO |
InChI: | InChI=1S/C13H19NO/c1-11(13-5-3-2-4-6-13)14-8-7-12(9-14)10-15/h2-6,11-12,15H,7-10H2,1H3/t11-,12+/m1/s1 |
InChI Key: | RQTYGPRJDFTUGU-NEPJUHHUSA-N |
LogP: | 1.99970 |
Publication Number | Title | Priority Date |
TW-201309689-A | Amino-containing pyrrolidone derivative | 20110207 |
JP-2013501708-A | Pyrimidone derivatives as tau protein kinase 1 inhibitors | 20090813 |
JP-5535310-B2 | Pyrimidone derivatives as tau protein kinase 1 inhibitors | 20090813 |
US-2012208797-A1 | Pyrimidone derivatives | 20090813 |
US-9006232-B2 | Pyrimidone derivatives | 20090813 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.14666423 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.14666423 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 23.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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