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1364663-23-9

1364663-23-9 | Carbamic acid, N-(3,5-difluoro-4-pyridinyl)-, 1,1-dimethylethyl ester

CAS No: 1364663-23-9 Catalog No: AG0011VH MDL No:MFCD22199252

Product Description

Catalog Number:
AG0011VH
Chemical Name:
Carbamic acid, N-(3,5-difluoro-4-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
1364663-23-9
Molecular Formula:
C10H12F2N2O2
Molecular Weight:
230.2113
MDL Number:
MFCD22199252
IUPAC Name:
tert-butyl N-(3,5-difluoropyridin-4-yl)carbamate
InChI:
InChI=1S/C10H12F2N2O2/c1-10(2,3)16-9(15)14-8-6(11)4-13-5-7(8)12/h4-5H,1-3H3,(H,13,14,15)
InChI Key:
GNWNEMPHMVGLOJ-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(F)cncc1F)OC(C)(C)C

Properties

Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.087g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.215g/mol
Monoisotopic Mass:
230.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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