200,000+ products from a single source!
sales@angenechem.com
127648-30-0 | 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-fluorophenyl)-, methyl ester, (1R,2S,3S,5S)-
CAS No: 127648-30-0 Catalog No: AG000X8R MDL No:MFCD07995047
Product Description
Catalog Number:
AG000X8R
Chemical Name:
8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-fluorophenyl)-, methyl ester, (1R,2S,3S,5S)-
CAS Number:
127648-30-0
Molecular Formula:
C15H18FNO2
Molecular Weight:
263.3073
MDL Number:
MFCD07995047
IUPAC Name:
methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
InChI:
InChI=1S/C15H18FNO2/c1-19-15(18)14-12(8-11-6-7-13(14)17-11)9-2-4-10(16)5-3-9/h2-5,11-14,17H,6-8H2,1H3/t11-,12+,13+,14-/m0/s1
InChI Key:
HQXXRDHSJOKBAP-DGAVXFQQSA-N
SMILES:
COC(=O)[C@@H]1[C@H]2CC[C@H](N2)C[C@@H]1c1ccc(cc1)F
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
263.132g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.312g/mol
Monoisotopic Mass:
263.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Competition between 11C-raclopride and endogenous dopamine in Parkinson's disease. | Nuclear medicine communications 20100201 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.