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Home > Boronic Acids > 1218789-40-2
1218789-40-2 | 1,3,2-Dioxaborolane, 2-(3-chloro-5-ethoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 1218789-40-2 Catalog No: AG00167R MDL No:MFCD12546577
Product Description
Catalog Number:
AG00167R
Chemical Name:
1,3,2-Dioxaborolane, 2-(3-chloro-5-ethoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1218789-40-2
Molecular Formula:
C14H20BClO3
Molecular Weight:
282.5708
MDL Number:
MFCD12546577
IUPAC Name:
2-(3-chloro-5-ethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H20BClO3/c1-6-17-12-8-10(7-11(16)9-12)15-18-13(2,3)14(4,5)19-15/h7-9H,6H2,1-5H3
InChI Key:
XVBSKDKUPIBZJR-UHFFFAOYSA-N
SMILES:
CCOc1cc(cc(c1)Cl)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.119g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.571g/mol
Monoisotopic Mass:
282.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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