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876710-64-4 | 1-Pyrrolidineethanamine,b-(4-fluorophenyl)-
CAS No: 876710-64-4 Catalog No: AG004O09 MDL No:MFCD07186362
Product Description
Catalog Number:
AG004O09
Chemical Name:
1-Pyrrolidineethanamine,b-(4-fluorophenyl)-
CAS Number:
876710-64-4
Molecular Formula:
C12H17FN2
Molecular Weight:
208.2752
MDL Number:
MFCD07186362
IUPAC Name:
2-(4-fluorophenyl)-2-pyrrolidin-1-ylethanamine
InChI:
InChI=1S/C12H17FN2/c13-11-5-3-10(4-6-11)12(9-14)15-7-1-2-8-15/h3-6,12H,1-2,7-9,14H2
InChI Key:
FFRVQTGCNAGNJO-UHFFFAOYSA-N
SMILES:
NCC(c1ccc(cc1)F)N1CCCC1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.138g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.28g/mol
Monoisotopic Mass:
208.138g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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