3-Ethoxycarbonylphenylboronic acid

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Catalog Number
ACM4334876
Product Name
3-Ethoxycarbonylphenylboronic acid
Structure
Structure
CAS
4334-87-6
Category
Boronic Acids
Synonyms
M-ETHOXYCARBONYLPHENYLBORONIC ACID;ETHYL 3-BORONOBENZOATE;3-(ETHOXYCARBONYL)BENZENEBORONIC ACID;3-ETHOXYCARBONYLPHENYLBORONIC ACID;3-CARBETHOXY-PHENYL-BORONIC ACID;AKOS BRN-0097;3-(Ethoxycarbonyl)Phenylboroni;3-Ethoxycarbonylphenylboronic acid,97%
IUPAC Name
(3-ethoxycarbonylphenyl)boronic acid
Molecular Weight
193.99g/mol
Molecular Formula
C9H11BO4
Canonical SMILES
B(C1=CC(=CC=C1)C(=O)OCC)(O)O
InChI
InChI=1S/C9H11BO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6,12-13H,2H2,1H3
InChI Key
REHVCPNQQBDOJJ-UHFFFAOYSA-N
Complexity
195
Covalently-Bonded Unit Count
1
Exact Mass
194.075039g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
14
Monoisotopic Mass
194.075039g/mol
Rotatable Bond Count
4
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