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Home > Boronic Acids > 736987-76-1
736987-76-1 | 2-[(E)-2-(FURAN-3-YL)ETHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
CAS No: 736987-76-1 Catalog No: AG01DSMG MDL No:
Product Description
Catalog Number:
AG01DSMG
Chemical Name:
2-[(E)-2-(FURAN-3-YL)ETHENYL]-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
CAS Number:
736987-76-1
Molecular Formula:
C12H17BO3
Molecular Weight:
220.0726
IUPAC Name:
2-[2-(furan-3-yl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H17BO3/c1-11(2)12(3,4)16-13(15-11)7-5-10-6-8-14-9-10/h5-9H,1-4H3
InChI Key:
FYGQTIPEOUZWMM-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)C=Cc1cocc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.127g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.075g/mol
Monoisotopic Mass:
220.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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