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Home > Boronic Acids > 850568-80-8

850568-80-8

850568-80-8 | 4-Chloro-2-ethoxyphenylboronic acid

CAS No: 850568-80-8 Catalog No: AG004YHX MDL No:MFCD03094940

Product Description

Catalog Number:
AG004YHX
Chemical Name:
4-Chloro-2-ethoxyphenylboronic acid
CAS Number:
850568-80-8
Molecular Formula:
C8H10BClO3
Molecular Weight:
200.4272
MDL Number:
MFCD03094940
IUPAC Name:
(4-chloro-2-ethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H10BClO3/c1-2-13-8-5-6(10)3-4-7(8)9(11)12/h3-5,11-12H,2H2,1H3
InChI Key:
NIWJJDHZRLYASL-UHFFFAOYSA-N
SMILES:
CCOc1cc(Cl)ccc1B(O)O

Properties

Complexity:
156  
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:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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