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Home > Boronic Acids > 1312611-41-8
1312611-41-8 | tert-butyl 6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)naphthalen-2-ylcarbaMate
CAS No: 1312611-41-8 Catalog No: AG00A06G MDL No:MFCD13191643
Product Description
Catalog Number:
AG00A06G
Chemical Name:
tert-butyl 6-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)naphthalen-2-ylcarbaMate
CAS Number:
1312611-41-8
Molecular Formula:
C21H28BNO4
Molecular Weight:
369.2623
MDL Number:
MFCD13191643
IUPAC Name:
tert-butyl N-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)naphthalen-2-yl]carbamate
InChI:
InChI=1S/C21H28BNO4/c1-19(2,3)25-18(24)23-17-11-9-14-12-16(10-8-15(14)13-17)22-26-20(4,5)21(6,7)27-22/h8-13H,1-7H3,(H,23,24)
InChI Key:
AGHCJCKEBFQSMP-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc2c(c1)ccc(c2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.211g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.268g/mol
Monoisotopic Mass:
369.211g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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