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Home > Boronic Acids > 908142-03-0
908142-03-0 | (3-(Hydroxymethyl);-4-methoxyphenyl);boronic acid
CAS No: 908142-03-0 Catalog No: AG006M2H MDL No:MFCD14155851
Product Description
Catalog Number:
AG006M2H
Chemical Name:
(3-(Hydroxymethyl);-4-methoxyphenyl);boronic acid
CAS Number:
908142-03-0
Molecular Formula:
C8H11BO4
Molecular Weight:
181.9815
MDL Number:
MFCD14155851
IUPAC Name:
[3-(hydroxymethyl)-4-methoxyphenyl]boronic acid
InChI:
InChI=1S/C8H11BO4/c1-13-8-3-2-7(9(11)12)4-6(8)5-10/h2-4,10-12H,5H2,1H3
InChI Key:
DOQUCBSZQOPLGT-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1OC)B(O)O
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
181.982g/mol
Monoisotopic Mass:
182.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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