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Home > Boronic Acids > 222840-73-5
222840-73-5 | (3-(Hydroxymethyl);thiophen-2-yl);boronic acid
CAS No: 222840-73-5 Catalog No: AG006Z1T MDL No:MFCD09952072
Product Description
Catalog Number:
AG006Z1T
Chemical Name:
(3-(Hydroxymethyl);thiophen-2-yl);boronic acid
CAS Number:
222840-73-5
Molecular Formula:
C5H7BO3S
Molecular Weight:
157.9833
MDL Number:
MFCD09952072
IUPAC Name:
[3-(hydroxymethyl)thiophen-2-yl]boronic acid
InChI:
InChI=1S/C5H7BO3S/c7-3-4-1-2-10-5(4)6(8)9/h1-2,7-9H,3H2
InChI Key:
HUUVNOIORZPHNG-UHFFFAOYSA-N
SMILES:
OCc1ccsc1B(O)O
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.021g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
157.978g/mol
Monoisotopic Mass:
158.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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