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Home > Boronic Acids > 850881-09-3
850881-09-3 | 2-(3-Hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 850881-09-3 Catalog No: AG003JIP MDL No:MFCD11045447
Product Description
Catalog Number:
AG003JIP
Chemical Name:
2-(3-Hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
850881-09-3
Molecular Formula:
C16H27BO2S
Molecular Weight:
294.2604
MDL Number:
MFCD11045447
IUPAC Name:
2-(3-hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H27BO2S/c1-6-7-8-9-10-13-11-12-20-14(13)17-18-15(2,3)16(4,5)19-17/h11-12H,6-10H2,1-5H3
InChI Key:
XCXAUPBHQCCWCI-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccsc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.182g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.26g/mol
Monoisotopic Mass:
294.182g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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