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1196976-68-7 | 2-Azabicyclo[2.1.1]hexane-1-carboxylic acid, 4-fluoro-
CAS No: 1196976-68-7 Catalog No: AG000PGM MDL No:MFCD12913296
Product Description
Catalog Number:
AG000PGM
Chemical Name:
2-Azabicyclo[2.1.1]hexane-1-carboxylic acid, 4-fluoro-
CAS Number:
1196976-68-7
Molecular Formula:
C6H8FNO2
Molecular Weight:
145.1316
MDL Number:
MFCD12913296
IUPAC Name:
4-fluoro-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
InChI:
InChI=1S/C6H8FNO2/c7-5-1-6(2-5,4(9)10)8-3-5/h8H,1-3H2,(H,9,10)
InChI Key:
LWZMDDIQHAFKJF-UHFFFAOYSA-N
SMILES:
OC(=O)C12NCC(C1)(C2)F
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
145.133g/mol
Monoisotopic Mass:
145.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.5
Literature
| Title | Journal |
|---|---|
| 4-Fluoro-2,4-methanoproline. | Organic letters 20091217 |
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