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Home > Boronic Acids > 915402-11-8
915402-11-8 | 5-Cyano-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzo[b]thiophene
CAS No: 915402-11-8 Catalog No: AG00GV0E MDL No:
Product Description
Catalog Number:
AG00GV0E
Chemical Name:
5-Cyano-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzo[b]thiophene
CAS Number:
915402-11-8
Molecular Formula:
C15H16BNO2S
Molecular Weight:
285.1690
IUPAC Name:
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile
InChI:
InChI=1S/C15H16BNO2S/c1-14(2)15(3,4)19-16(18-14)13-8-11-7-10(9-17)5-6-12(11)20-13/h5-8H,1-4H3
InChI Key:
PEENVPPNRCEMSM-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)cc(s2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.099g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.168g/mol
Monoisotopic Mass:
285.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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