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262279-96-9 | Cyclopentanecarboxylic acid, 3-amino-4-fluoro-, (1R,3S,4S)-
CAS No: 262279-96-9 Catalog No: AG002SCG MDL No:
Product Description
Catalog Number:
AG002SCG
Chemical Name:
Cyclopentanecarboxylic acid, 3-amino-4-fluoro-, (1R,3S,4S)-
CAS Number:
262279-96-9
Molecular Formula:
C6H10FNO2
Molecular Weight:
147.1475
IUPAC Name:
(1R,3S,4S)-3-amino-4-fluorocyclopentane-1-carboxylic acid
InChI:
InChI=1S/C6H10FNO2/c7-4-1-3(6(9)10)2-5(4)8/h3-5H,1-2,8H2,(H,9,10)/t3-,4-,5-/m0/s1
InChI Key:
MMLGUKKNNZUWAE-YUPRTTJUSA-N
SMILES:
F[C@H]1C[C@@H](C[C@@H]1N)C(=O)O
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
147.07g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
147.149g/mol
Monoisotopic Mass:
147.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.5
Literature
| Title | Journal |
|---|---|
| Mechanistic crystallography. Mechanism of inactivation of gamma-aminobutyric acid aminotransferase by (1R,3S,4S)-3-amino-4-fluorocyclopentane-1-carboxylic acid as elucidated by crystallography. | Biochemistry 20041109 |
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