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Home > Boronic Acids > 1256360-18-5
1256360-18-5 | 1,3,2-Dioxaborolane, 2-(4-chloro-2-fluoro-5-propoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 1256360-18-5 Catalog No: AG000O7Q MDL No:MFCD16295123
Product Description
Catalog Number:
AG000O7Q
Chemical Name:
1,3,2-Dioxaborolane, 2-(4-chloro-2-fluoro-5-propoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1256360-18-5
Molecular Formula:
C15H21BClFO3
Molecular Weight:
314.5878
MDL Number:
MFCD16295123
IUPAC Name:
2-(4-chloro-2-fluoro-5-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C15H21BClFO3/c1-6-7-19-13-8-10(12(18)9-11(13)17)16-20-14(2,3)15(4,5)21-16/h8-9H,6-7H2,1-5H3
InChI Key:
ATFCCDUHYXYSHT-UHFFFAOYSA-N
SMILES:
CCCOc1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Cl)F
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.588g/mol
Monoisotopic Mass:
314.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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