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Home > Boronic Acids > 1256354-90-1
1256354-90-1 | Boronic acid, B-[2,4-dichloro-5-(cyclopentyloxy)phenyl]-
CAS No: 1256354-90-1 Catalog No: AG000O34 MDL No:MFCD17015758
Product Description
Catalog Number:
AG000O34
Chemical Name:
Boronic acid, B-[2,4-dichloro-5-(cyclopentyloxy)phenyl]-
CAS Number:
1256354-90-1
Molecular Formula:
C11H13BCl2O3
Molecular Weight:
274.9361
MDL Number:
MFCD17015758
IUPAC Name:
(2,4-dichloro-5-cyclopentyloxyphenyl)boronic acid
InChI:
InChI=1S/C11H13BCl2O3/c13-9-6-10(14)11(5-8(9)12(15)16)17-7-3-1-2-4-7/h5-7,15-16H,1-4H2
InChI Key:
RFDLUZMLHLCHJL-UHFFFAOYSA-N
SMILES:
OB(c1cc(OC2CCCC2)c(cc1Cl)Cl)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.033g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
274.932g/mol
Monoisotopic Mass:
274.033g/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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