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Home > Boronic Acids > 849062-17-5
849062-17-5 | 2-([2,2':5',2''-Terthiophen]-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 849062-17-5 Catalog No: AG004M00 MDL No:
Product Description
Catalog Number:
AG004M00
Chemical Name:
2-([2,2':5',2''-Terthiophen]-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
849062-17-5
Molecular Formula:
C18H19BO2S3
Molecular Weight:
374.3483
IUPAC Name:
4,4,5,5-tetramethyl-2-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C18H19BO2S3/c1-17(2)18(3,4)21-19(20-17)16-10-9-15(24-16)14-8-7-13(23-14)12-6-5-11-22-12/h5-11H,1-4H3
InChI Key:
FIUQKESHHZFUGG-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(s1)c1ccc(s1)c1cccs1
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.064g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.338g/mol
Monoisotopic Mass:
374.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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