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Home > Boronic Acids > 511295-09-3
511295-09-3 | (5-CHLORO-4-METHOXY-2-METHYLPHENYL)BORONIC ACID
CAS No: 511295-09-3 Catalog No: AG00DIH7 MDL No:MFCD09054938
Product Description
Catalog Number:
AG00DIH7
Chemical Name:
(5-CHLORO-4-METHOXY-2-METHYLPHENYL)BORONIC ACID
CAS Number:
511295-09-3
Molecular Formula:
C8H10BClO3
Molecular Weight:
200.4272
MDL Number:
MFCD09054938
IUPAC Name:
(5-chloro-4-methoxy-2-methylphenyl)boronic acid
InChI:
InChI=1S/C8H10BClO3/c1-5-3-8(13-2)7(10)4-6(5)9(11)12/h3-4,11-12H,1-2H3
InChI Key:
RYCISTVGQKCVHG-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(cc1Cl)B(O)O
Properties
Complexity:
168
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:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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