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Home > Boronic Acids > 279261-81-3
279261-81-3 | Boronic acid, (3-chloro-4-ethoxyphenyl)-
CAS No: 279261-81-3 Catalog No: AG00I58X MDL No:MFCD03701556
Product Description
Catalog Number:
AG00I58X
Chemical Name:
Boronic acid, (3-chloro-4-ethoxyphenyl)-
CAS Number:
279261-81-3
Molecular Formula:
C8H10BClO3
Molecular Weight:
200.4272
MDL Number:
MFCD03701556
IUPAC Name:
(3-chloro-4-ethoxyphenyl)boronic acid
InChI:
InChI=1S/C8H10BClO3/c1-2-13-8-4-3-6(9(11)12)5-7(8)10/h3-5,11-12H,2H2,1H3
InChI Key:
QZMQZKMQXURQNC-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1Cl)B(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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