200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 248275-95-8
248275-95-8 | 1,5-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-
CAS No: 248275-95-8 Catalog No: AG002PL9 MDL No:
Product Description
Catalog Number:
AG002PL9
Chemical Name:
1,5-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-
CAS Number:
248275-95-8
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
11-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-5-ol
InChI:
InChI=1S/C12H15NO/c14-11-1-2-12-9(5-11)3-8-4-10(12)7-13-6-8/h1-2,5,8,10,13-14H,3-4,6-7H2
InChI Key:
UEUSVFILMLMQMI-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CC1CC2CNC1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| In pursuit of alpha4beta2 nicotinic receptor partial agonists for smoking cessation: carbon analogs of (-)-cytisine. | Bioorganic & medicinal chemistry letters 20050615 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.