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Home > Fluorides > 1260881-31-9
1260881-31-9 | Carbamic acid, N-(3-fluoro-2-pyridinyl)-, phenylmethyl ester
CAS No: 1260881-31-9 Catalog No: AG000RI5 MDL No:
Product Description
Catalog Number:
AG000RI5
Chemical Name:
Carbamic acid, N-(3-fluoro-2-pyridinyl)-, phenylmethyl ester
CAS Number:
1260881-31-9
Molecular Formula:
C13H11FN2O2
Molecular Weight:
246.2370
IUPAC Name:
benzyl N-(3-fluoropyridin-2-yl)carbamate
InChI:
InChI=1S/C13H11FN2O2/c14-11-7-4-8-15-12(11)16-13(17)18-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,15,16,17)
InChI Key:
CIUXWZLHOYZWSA-UHFFFAOYSA-N
SMILES:
O=C(Nc1ncccc1F)OCc1ccccc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.241g/mol
Monoisotopic Mass:
246.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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