1-(Aminomethyl)-3-benzyl-3-azabicyclo[3.1.0]hexane - CAS 134574-95-1
Catalog: |
BB007958 |
Product Name: |
1-(Aminomethyl)-3-benzyl-3-azabicyclo[3.1.0]hexane |
CAS: |
134574-95-1 |
Synonyms: |
[3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-1-yl]methanamine; (3-benzyl-3-azabicyclo[3.1.0]hexan-1-yl)methanamine |
IUPAC Name: | (3-benzyl-3-azabicyclo[3.1.0]hexan-1-yl)methanamine |
Description: | 1-(Aminomethyl)-3-benzyl-3-azabicyclo[3.1.0]hexane (CAS# 134574-95-1 ) is a useful research chemical. |
Molecular Weight: | 202.30 |
Molecular Formula: | C13H18N2 |
Canonical SMILES: | C1C2C1(CN(C2)CC3=CC=CC=C3)CN |
InChI: | InChI=1S/C13H18N2/c14-9-13-6-12(13)8-15(10-13)7-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2 |
InChI Key: | JUOOTPCVPUXCDN-UHFFFAOYSA-N |
Boiling Point: | 294.8 ℃ at 760 mmHg |
Density: | 1.147 g/cm3 |
LogP: | 2.10540 |
Publication Number | Title | Priority Date |
EP-1594871-A1 | Substituted azabicyclo hexane derivatives as muscarinic receptor antagonists | 20030207 |
US-2007010568-A1 | Substituted azabicyclo hexane derivatives as muscarinic receptor antagonists | 20030207 |
WO-2004069835-A1 | Substituted azabicyclo hexane derivatives as muscarinic receptor antagonists | 20030207 |
DE-60225195-T2 | FLAVAXATE DERIVATIVES AS MUSCARIN RECEPTOR ANTAGONISTS | 20021223 |
EP-1581522-A1 | Flavaxate derivatives as muscarinic receptor antagonists | 20021223 |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.146998583 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.3 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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