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Home > Boronic Acids > 1003298-84-7
1003298-84-7 | Phenol, 2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 1003298-84-7 Catalog No: AG0001M8 MDL No:MFCD05663844
Product Description
Catalog Number:
AG0001M8
Chemical Name:
Phenol, 2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1003298-84-7
Molecular Formula:
C13H18BClO4
Molecular Weight:
284.5436
MDL Number:
MFCD05663844
IUPAC Name:
2-chloro-6-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI:
InChI=1S/C13H18BClO4/c1-12(2)13(3,4)19-14(18-12)8-6-9(15)11(16)10(7-8)17-5/h6-7,16H,1-5H3
InChI Key:
XBEJPOZGAPQFPL-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1O)Cl)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.099g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.543g/mol
Monoisotopic Mass:
284.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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