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Home > Boronic Acids > 1661043-48-6
1661043-48-6 | (1-Ethyl-1,3-benzodiazol-5-yl)boronic acid
CAS No: 1661043-48-6 Catalog No: AG00HZ5A MDL No:MFCD27935540
Product Description
Catalog Number:
AG00HZ5A
Chemical Name:
(1-Ethyl-1,3-benzodiazol-5-yl)boronic acid
CAS Number:
1661043-48-6
Molecular Formula:
C9H11BN2O2
Molecular Weight:
190.0068
MDL Number:
MFCD27935540
IUPAC Name:
(1-ethylbenzimidazol-5-yl)boronic acid
InChI:
InChI=1S/C9H11BN2O2/c1-2-12-6-11-8-5-7(10(13)14)3-4-9(8)12/h3-6,13-14H,2H2,1H3
InChI Key:
AKLWXFSUGCBRFR-UHFFFAOYSA-N
SMILES:
CCn1cnc2c1ccc(c2)B(O)O
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.009g/mol
Monoisotopic Mass:
190.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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