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Home > Boronic Acids > 26076-46-0
26076-46-0 | Boronic acid, B,B'-2,5-thiophenediylbis-
CAS No: 26076-46-0 Catalog No: AG002RKU MDL No:MFCD01114699
Product Description
Catalog Number:
AG002RKU
Chemical Name:
Boronic acid, B,B'-2,5-thiophenediylbis-
CAS Number:
26076-46-0
Molecular Formula:
C4H6B2O4S
Molecular Weight:
171.7750
MDL Number:
MFCD01114699
IUPAC Name:
(5-boronothiophen-2-yl)boronic acid
InChI:
InChI=1S/C4H6B2O4S/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2,7-10H
InChI Key:
SKFDVFMUXZWWOW-UHFFFAOYSA-N
SMILES:
OB(c1ccc(s1)B(O)O)O
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.017g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
171.768g/mol
Monoisotopic Mass:
172.017g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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