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1256346-48-1 | Boronic acid, B-[2,4-dichloro-5-[2-(dimethylamino)ethoxy]phenyl]-
CAS No: 1256346-48-1 Catalog No: AG000O20 MDL No:MFCD17015755
Product Description
Catalog Number:
AG000O20
Chemical Name:
Boronic acid, B-[2,4-dichloro-5-[2-(dimethylamino)ethoxy]phenyl]-
CAS Number:
1256346-48-1
Molecular Formula:
C10H14BCl2NO3
Molecular Weight:
277.9401
MDL Number:
MFCD17015755
IUPAC Name:
[2,4-dichloro-5-[2-(dimethylamino)ethoxy]phenyl]boronic acid
InChI:
InChI=1S/C10H14BCl2NO3/c1-14(2)3-4-17-10-5-7(11(15)16)8(12)6-9(10)13/h5-6,15-16H,3-4H2,1-2H3
InChI Key:
UTMSRBAESHGWBY-UHFFFAOYSA-N
SMILES:
OB(c1cc(OCCN(C)C)c(cc1Cl)Cl)O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.044g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.936g/mol
Monoisotopic Mass:
277.044g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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