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957121-15-2

957121-15-2 | (6-Bromo-2-chloro-3-ethoxyphenyl);boronic acid

CAS No: 957121-15-2 Catalog No: AG003BYO MDL No:MFCD09800871

Product Description

Catalog Number:
AG003BYO
Chemical Name:
(6-Bromo-2-chloro-3-ethoxyphenyl);boronic acid
CAS Number:
957121-15-2
Molecular Formula:
C8H9BBrClO3
Molecular Weight:
279.3233
MDL Number:
MFCD09800871
IUPAC Name:
(6-bromo-2-chloro-3-ethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H9BBrClO3/c1-2-14-6-4-3-5(10)7(8(6)11)9(12)13/h3-4,12-13H,2H2,1H3
InChI Key:
KRYOSFPUNATDPK-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1Cl)B(O)O)Br

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.952g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.321g/mol
Monoisotopic Mass:
277.952g/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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