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Home > Boronic Acids > 1105675-61-3
1105675-61-3 | TERT-BUTYL 5-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YLCARBAMATE
CAS No: 1105675-61-3 Catalog No: AG0090HH MDL No:MFCD11857618
Product Description
Catalog Number:
AG0090HH
Chemical Name:
TERT-BUTYL 5-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YLCARBAMATE
CAS Number:
1105675-61-3
Molecular Formula:
C17H27BN2O5
Molecular Weight:
350.2177
MDL Number:
MFCD11857618
IUPAC Name:
tert-butyl N-[5-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]carbamate
InChI:
InChI=1S/C17H27BN2O5/c1-15(2,3)23-14(21)20-11-9-19-10-12(22-8)13(11)18-24-16(4,5)17(6,7)25-18/h9-10H,1-8H3,(H,20,21)
InChI Key:
SMZCWXDCKVKEMX-UHFFFAOYSA-N
SMILES:
COc1cncc(c1B1OC(C(O1)(C)C)(C)C)NC(=O)OC(C)(C)C
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.201g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.222g/mol
Monoisotopic Mass:
350.201g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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