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Home > Fluorides > 1262526-44-2
1262526-44-2 | L-Proline, 4-[(3-fluorophenyl)methyl]-, (4R)-
CAS No: 1262526-44-2 Catalog No: AG000SEM MDL No:MFCD07363501
Product Description
Catalog Number:
AG000SEM
Chemical Name:
L-Proline, 4-[(3-fluorophenyl)methyl]-, (4R)-
CAS Number:
1262526-44-2
Molecular Formula:
C12H14FNO2
Molecular Weight:
223.2435
MDL Number:
MFCD07363501
IUPAC Name:
(2S,4R)-4-[(3-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C12H14FNO2/c13-10-3-1-2-8(5-10)4-9-6-11(12(15)16)14-7-9/h1-3,5,9,11,14H,4,6-7H2,(H,15,16)/t9-,11+/m1/s1
InChI Key:
RGFRGRZSMVXTLF-KOLCDFICSA-N
SMILES:
OC(=O)[C@H]1NC[C@@H](C1)Cc1cccc(c1)F
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
223.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.247g/mol
Monoisotopic Mass:
223.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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