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480424-71-3 | tert-butyl [2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate
CAS No: 480424-71-3 Catalog No: AG00I8R3 MDL No:MFCD03453657
Product Description
Catalog Number:
AG00I8R3
Chemical Name:
tert-butyl [2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate
CAS Number:
480424-71-3
Molecular Formula:
C17H25BO5
Molecular Weight:
320.1884
MDL Number:
MFCD03453657
IUPAC Name:
tert-butyl [2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate
InChI:
InChI=1S/C17H25BO5/c1-15(2,3)21-14(19)20-13-11-9-8-10-12(13)18-22-16(4,5)17(6,7)23-18/h8-11H,1-7H3
InChI Key:
JWSZKSKLMRKJHM-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Oc1ccccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.18g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.192g/mol
Monoisotopic Mass:
320.18g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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