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Home > Boronic Acids > 325786-18-3
325786-18-3 | 2,4-Dichloro-5-isopropoxyphenylboronic acid
CAS No: 325786-18-3 Catalog No: AG00CLO1 MDL No:MFCD17015752
Product Description
Catalog Number:
AG00CLO1
Chemical Name:
2,4-Dichloro-5-isopropoxyphenylboronic acid
CAS Number:
325786-18-3
Molecular Formula:
C9H11BCl2O3
Molecular Weight:
248.8988
MDL Number:
MFCD17015752
IUPAC Name:
(2,4-dichloro-5-propan-2-yloxyphenyl)boronic acid
InChI:
InChI=1S/C9H11BCl2O3/c1-5(2)15-9-3-6(10(13)14)7(11)4-8(9)12/h3-5,13-14H,1-2H3
InChI Key:
OMFHFEFPEHEGLG-UHFFFAOYSA-N
SMILES:
CC(Oc1cc(B(O)O)c(cc1Cl)Cl)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.018g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.894g/mol
Monoisotopic Mass:
248.018g/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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