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Home > Pyridines > 1240620-37-4
1240620-37-4 | Carbamic acid, N-[(5-hydroxy-2-pyridinyl)methyl]-, 1,1-dimethylethyl ester
CAS No: 1240620-37-4 Catalog No: AG000LHT MDL No:
Product Description
Catalog Number:
AG000LHT
Chemical Name:
Carbamic acid, N-[(5-hydroxy-2-pyridinyl)methyl]-, 1,1-dimethylethyl ester
CAS Number:
1240620-37-4
Molecular Formula:
C11H16N2O3
Molecular Weight:
224.2563
IUPAC Name:
tert-butyl N-[(5-hydroxypyridin-2-yl)methyl]carbamate
InChI:
InChI=1S/C11H16N2O3/c1-11(2,3)16-10(15)13-6-8-4-5-9(14)7-12-8/h4-5,7,14H,6H2,1-3H3,(H,13,15)
InChI Key:
RZEQMSGEJUDANY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccc(cn1)O
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.26g/mol
Monoisotopic Mass:
224.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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