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Home > Boronic Acids > 221006-65-1
221006-65-1 | 4-(2-Hydroxyethoxy)phenylboronic acid
CAS No: 221006-65-1 Catalog No: AG00BJ93 MDL No:MFCD22414430
Product Description
Catalog Number:
AG00BJ93
Chemical Name:
4-(2-Hydroxyethoxy)phenylboronic acid
CAS Number:
221006-65-1
Molecular Formula:
C8H11BO4
Molecular Weight:
181.9815
MDL Number:
MFCD22414430
IUPAC Name:
[4-(2-hydroxyethoxy)phenyl]boronic acid
InChI:
InChI=1S/C8H11BO4/c10-5-6-13-8-3-1-7(2-4-8)9(11)12/h1-4,10-12H,5-6H2
InChI Key:
DYXUTUGXJBKZLD-UHFFFAOYSA-N
SMILES:
OCCOc1ccc(cc1)B(O)O
Properties
Complexity:
134
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:
4
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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