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944935-37-9 | tert-Butyl (5-iodo-4-methoxypyridin-2-yl);carbamate
CAS No: 944935-37-9 Catalog No: AG00H6CO MDL No:MFCD09763662
Product Description
Catalog Number:
AG00H6CO
Chemical Name:
tert-Butyl (5-iodo-4-methoxypyridin-2-yl);carbamate
CAS Number:
944935-37-9
Molecular Formula:
C11H15IN2O3
Molecular Weight:
350.1529
MDL Number:
MFCD09763662
IUPAC Name:
tert-butyl N-(5-iodo-4-methoxypyridin-2-yl)carbamate
InChI:
InChI=1S/C11H15IN2O3/c1-11(2,3)17-10(15)14-9-5-8(16-4)7(12)6-13-9/h5-6H,1-4H3,(H,13,14,15)
InChI Key:
DBHLXRWGUVAAOF-UHFFFAOYSA-N
SMILES:
COc1cc(ncc1I)NC(=O)OC(C)(C)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.013g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.156g/mol
Monoisotopic Mass:
350.013g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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