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Home > Pyridines > 631910-23-1
631910-23-1 | tert-butyl N-(5-methyl-3-pyridyl)carbamate
CAS No: 631910-23-1 Catalog No: AG003A2I MDL No:MFCD20484219
Product Description
Catalog Number:
AG003A2I
Chemical Name:
tert-butyl N-(5-methyl-3-pyridyl)carbamate
CAS Number:
631910-23-1
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
MDL Number:
MFCD20484219
IUPAC Name:
tert-butyl N-(5-methylpyridin-3-yl)carbamate
InChI:
InChI=1S/C11H16N2O2/c1-8-5-9(7-12-6-8)13-10(14)15-11(2,3)4/h5-7H,1-4H3,(H,13,14)
InChI Key:
XYPVJWFXUXXBOT-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cncc(c1)C
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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