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Home > Fluorides > 876162-15-1
876162-15-1 | (R)-tert-Butyl 1-(3-fluorobenzyl)pyrrolidin-3-ylcarbamate
CAS No: 876162-15-1 Catalog No: AG01EY2L MDL No:
Product Description
Catalog Number:
AG01EY2L
Chemical Name:
(R)-tert-Butyl 1-(3-fluorobenzyl)pyrrolidin-3-ylcarbamate
CAS Number:
876162-15-1
Molecular Formula:
C16H23FN2O2
Molecular Weight:
294.3644
IUPAC Name:
tert-butyl N-[(3R)-1-[(3-fluorophenyl)methyl]pyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C16H23FN2O2/c1-16(2,3)21-15(20)18-14-7-8-19(11-14)10-12-5-4-6-13(17)9-12/h4-6,9,14H,7-8,10-11H2,1-3H3,(H,18,20)/t14-/m1/s1
InChI Key:
GTZGSEIULCPYBX-CQSZACIVSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H]1CCN(C1)Cc1cccc(c1)F
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
294.174g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.37g/mol
Monoisotopic Mass:
294.174g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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