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Home > Boronic Acids > 1256354-88-7

1256354-88-7

1256354-88-7 | Boronic acid, B-(5-butoxy-2,4-dichlorophenyl)-

CAS No: 1256354-88-7 Catalog No: AG000O36 MDL No:MFCD17015756

Product Description

Catalog Number:
AG000O36
Chemical Name:
Boronic acid, B-(5-butoxy-2,4-dichlorophenyl)-
CAS Number:
1256354-88-7
Molecular Formula:
C10H13BCl2O3
Molecular Weight:
262.9254
MDL Number:
MFCD17015756
IUPAC Name:
(5-butoxy-2,4-dichlorophenyl)boronic acid
InChI:
InChI=1S/C10H13BCl2O3/c1-2-3-4-16-10-5-7(11(14)15)8(12)6-9(10)13/h5-6,14-15H,2-4H2,1H3
InChI Key:
UNUSRHVSANUKKR-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(B(O)O)c(cc1Cl)Cl

Properties

Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.033g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.921g/mol
Monoisotopic Mass:
262.033g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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