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1398923-95-9

1398923-95-9 | Phenol, 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

CAS No: 1398923-95-9 Catalog No: AG001BRP MDL No:MFCD16994432

Product Description

Catalog Number:
AG001BRP
Chemical Name:
Phenol, 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1398923-95-9
Molecular Formula:
C12H16BFO3
Molecular Weight:
238.0630
MDL Number:
MFCD16994432
IUPAC Name:
4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI:
InChI=1S/C12H16BFO3/c1-11(2)12(3,4)17-13(16-11)9-7-8(15)5-6-10(9)14/h5-7,15H,1-4H3
InChI Key:
GXQGRXFGHPKHTH-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(O)ccc1F

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.118g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.065g/mol
Monoisotopic Mass:
238.118g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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