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Home > Boronic Acids > 1256355-00-6
1256355-00-6 | Boronic acid, B-[4-chloro-3-(2-methoxyethoxy)phenyl]-
CAS No: 1256355-00-6 Catalog No: AG000O2U MDL No:MFCD17015766
Product Description
Catalog Number:
AG000O2U
Chemical Name:
Boronic acid, B-[4-chloro-3-(2-methoxyethoxy)phenyl]-
CAS Number:
1256355-00-6
Molecular Formula:
C9H12BClO4
Molecular Weight:
230.4532
MDL Number:
MFCD17015766
IUPAC Name:
[4-chloro-3-(2-methoxyethoxy)phenyl]boronic acid
InChI:
InChI=1S/C9H12BClO4/c1-14-4-5-15-9-6-7(10(12)13)2-3-8(9)11/h2-3,6,12-13H,4-5H2,1H3
InChI Key:
DQKODDSMRUVJSP-UHFFFAOYSA-N
SMILES:
COCCOc1cc(ccc1Cl)B(O)O
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.451g/mol
Monoisotopic Mass:
230.052g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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