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Home > Boronic Acids > 875781-62-7
875781-62-7 | 5-(ETHOXYCARBONYL)-3-PYRIDINYL BORONIC ACID
CAS No: 875781-62-7 Catalog No: AG00H0YN MDL No:MFCD09952043
Product Description
Catalog Number:
AG00H0YN
Chemical Name:
5-(ETHOXYCARBONYL)-3-PYRIDINYL BORONIC ACID
CAS Number:
875781-62-7
Molecular Formula:
C8H10BNO4
Molecular Weight:
194.9803
MDL Number:
MFCD09952043
IUPAC Name:
(5-ethoxycarbonylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C8H10BNO4/c1-2-14-8(11)6-3-7(9(12)13)5-10-4-6/h3-5,12-13H,2H2,1H3
InChI Key:
ANWGKOKCTGJGCD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cncc(c1)B(O)O
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.07g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.981g/mol
Monoisotopic Mass:
195.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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