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Home > Boronic Acids > 1204763-24-5
1204763-24-5 | (TRIMETHYLTHIOPHEN-3-YL)BORONIC ACID
CAS No: 1204763-24-5 Catalog No: AG01BNIA MDL No:MFCD22189547
Product Description
Catalog Number:
AG01BNIA
Chemical Name:
(TRIMETHYLTHIOPHEN-3-YL)BORONIC ACID
CAS Number:
1204763-24-5
Molecular Formula:
C7H11BO2S
Molecular Weight:
170.0370
MDL Number:
MFCD22189547
IUPAC Name:
(2,4,5-trimethylthiophen-3-yl)boronic acid
InChI:
InChI=1S/C7H11BO2S/c1-4-5(2)11-6(3)7(4)8(9)10/h9-10H,1-3H3
InChI Key:
JECYWGUGFQNQNW-UHFFFAOYSA-N
SMILES:
OB(c1c(C)sc(c1C)C)O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.057g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.033g/mol
Monoisotopic Mass:
170.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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