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Home > Boronic Acids > 1451391-73-3
1451391-73-3 | 5-Carboxy-2-ethoxyphenylboronic acid
CAS No: 1451391-73-3 Catalog No: AG00HXDJ MDL No:MFCD11044923
Product Description
Catalog Number:
AG00HXDJ
Chemical Name:
5-Carboxy-2-ethoxyphenylboronic acid
CAS Number:
1451391-73-3
Molecular Formula:
C9H11BO5
Molecular Weight:
209.9916
MDL Number:
MFCD11044923
IUPAC Name:
3-borono-4-ethoxybenzoic acid
InChI:
InChI=1S/C9H11BO5/c1-2-15-8-4-3-6(9(11)12)5-7(8)10(13)14/h3-5,13-14H,2H2,1H3,(H,11,12)
InChI Key:
CMUVOHRXIPPHFW-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1B(O)O)C(=O)O
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.07g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
209.992g/mol
Monoisotopic Mass:
210.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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