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2096331-64-3

2096331-64-3 | 2-Isobutoxy-4-(trifluoromethyl)phenylboronic acid

CAS No: 2096331-64-3 Catalog No: AG01EHGY MDL No:MFCD21609513

Product Description

Catalog Number:
AG01EHGY
Chemical Name:
2-Isobutoxy-4-(trifluoromethyl)phenylboronic acid
CAS Number:
2096331-64-3
MDL Number:
MFCD21609513
IUPAC Name:
[2-(2-methylpropoxy)-4-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H14BF3O3/c1-7(2)6-18-10-5-8(11(13,14)15)3-4-9(10)12(16)17/h3-5,7,16-17H,6H2,1-2H3
InChI Key:
HNSBTOIZQFKAHB-UHFFFAOYSA-N

Properties

Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.099g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.035g/mol
Monoisotopic Mass:
262.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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