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Home > Boronic Acids > 219735-99-6
219735-99-6 | 2-Chloro-4-methoxyphenylboronic acid
CAS No: 219735-99-6 Catalog No: AG007OJS MDL No:MFCD03411935
Product Description
Catalog Number:
AG007OJS
Chemical Name:
2-Chloro-4-methoxyphenylboronic acid
CAS Number:
219735-99-6
Molecular Formula:
C7H8BClO3
Molecular Weight:
186.4006
MDL Number:
MFCD03411935
IUPAC Name:
(2-chloro-4-methoxyphenyl)boronic acid
InChI:
InChI=1S/C7H8BClO3/c1-12-5-2-3-6(8(10)11)7(9)4-5/h2-4,10-11H,1H3
InChI Key:
LOCGPWGCRVKCFN-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)Cl)B(O)O
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.398g/mol
Monoisotopic Mass:
186.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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