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Home > Fluorides > 1419221-63-8
1419221-63-8 | Carbamic acid, N-[4-(difluoromethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester
CAS No: 1419221-63-8 Catalog No: AG001HE0 MDL No:MFCD26404019
Product Description
Catalog Number:
AG001HE0
Chemical Name:
Carbamic acid, N-[4-(difluoromethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester
CAS Number:
1419221-63-8
Molecular Formula:
C11H14F2N2O2
Molecular Weight:
244.2379
MDL Number:
MFCD26404019
IUPAC Name:
tert-butyl N-[4-(difluoromethyl)pyridin-2-yl]carbamate
InChI:
InChI=1S/C11H14F2N2O2/c1-11(2,3)17-10(16)15-8-6-7(9(12)13)4-5-14-8/h4-6,9H,1-3H3,(H,14,15,16)
InChI Key:
NNHXADRSFAXQRK-UHFFFAOYSA-N
SMILES:
FC(c1ccnc(c1)NC(=O)OC(C)(C)C)F
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.102g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.242g/mol
Monoisotopic Mass:
244.102g/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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