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412343-21-6 | 2-CHLORO-4-(((1,1-DIMETHYLETHYL)DIMETHYLSILYL)OXY) PHENYLBORONIC ACID
CAS No: 412343-21-6 Catalog No: AG00BXGO MDL No:MFCD04037223
Product Description
Catalog Number:
AG00BXGO
Chemical Name:
2-CHLORO-4-(((1,1-DIMETHYLETHYL)DIMETHYLSILYL)OXY) PHENYLBORONIC ACID
CAS Number:
412343-21-6
Molecular Formula:
C12H20BClO3Si
Molecular Weight:
286.6349
MDL Number:
MFCD04037223
IUPAC Name:
[4-[tert-butyl(dimethyl)silyl]oxy-2-chlorophenyl]boronic acid
InChI:
InChI=1S/C12H20BClO3Si/c1-12(2,3)18(4,5)17-9-6-7-10(13(15)16)11(14)8-9/h6-8,15-16H,1-5H3
InChI Key:
KPSMCFBSUNQTHV-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1Cl)O[Si](C(C)(C)C)(C)C)O
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.096g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.634g/mol
Monoisotopic Mass:
286.096g/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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