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1684427-19-7

1684427-19-7 | 2-(7-Fluoro-2H-1,3-benzodioxol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS No: 1684427-19-7 Catalog No: AG00HZ8E MDL No:MFCD20441925

Product Description

Catalog Number:
AG00HZ8E
Chemical Name:
2-(7-Fluoro-2H-1,3-benzodioxol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1684427-19-7
Molecular Formula:
C13H16BFO4
Molecular Weight:
266.0731
MDL Number:
MFCD20441925
IUPAC Name:
2-(7-fluoro-1,3-benzodioxol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H16BFO4/c1-12(2)13(3,4)19-14(18-12)8-5-6-9(15)11-10(8)16-7-17-11/h5-6H,7H2,1-4H3
InChI Key:
VDTGYHYHKYOTDB-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1OCO2)B1OC(C(O1)(C)C)(C)C

Properties

Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.113g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.075g/mol
Monoisotopic Mass:
266.113g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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