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Home > Boronic Acids > 1256345-73-9
1256345-73-9 | Boronic acid, B-(3-chloro-5-ethoxyphenyl)-
CAS No: 1256345-73-9 Catalog No: AG000NZS MDL No:MFCD16660280
Product Description
Catalog Number:
AG000NZS
Chemical Name:
Boronic acid, B-(3-chloro-5-ethoxyphenyl)-
CAS Number:
1256345-73-9
Molecular Formula:
C8H10BClO3
Molecular Weight:
200.4272
MDL Number:
MFCD16660280
IUPAC Name:
(3-chloro-5-ethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H10BClO3/c1-2-13-8-4-6(9(11)12)3-7(10)5-8/h3-5,11-12H,2H2,1H3
InChI Key:
DKMSXBHJXIDTTM-UHFFFAOYSA-N
SMILES:
CCOc1cc(cc(c1)Cl)B(O)O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.425g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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