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Home > Pyridines > 115309-58-5
115309-58-5 | 3-Pyridinecarboxamide, 6-chloro-N-(1,1-dimethylethyl)-
CAS No: 115309-58-5 Catalog No: AG000GL1 MDL No:MFCD08460992
Product Description
Catalog Number:
AG000GL1
Chemical Name:
3-Pyridinecarboxamide, 6-chloro-N-(1,1-dimethylethyl)-
CAS Number:
115309-58-5
Molecular Formula:
C10H13ClN2O
Molecular Weight:
212.6760
MDL Number:
MFCD08460992
IUPAC Name:
N-tert-butyl-6-chloropyridine-3-carboxamide
InChI:
InChI=1S/C10H13ClN2O/c1-10(2,3)13-9(14)7-4-5-8(11)12-6-7/h4-6H,1-3H3,(H,13,14)
InChI Key:
OJIUMMXADBUVFN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)NC(C)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.677g/mol
Monoisotopic Mass:
212.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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