Home Boronic acids [3-(diethylaminomethyl)phenyl]boronic acid

[3-(diethylaminomethyl)phenyl]boronic acid

CAS No.:
944483-39-0
Catalog Number:
AG00II6H
Molecular Formula:
C11H18BNO2
Molecular Weight:
207.0771
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Product Description
Catalog Number:
AG00II6H
Chemical Name:
[3-(diethylaminomethyl)phenyl]boronic acid
CAS Number:
944483-39-0
Molecular Formula:
C11H18BNO2
Molecular Weight:
207.0771
MDL Number:
MFCD14687157
IUPAC Name:
[3-(diethylaminomethyl)phenyl]boronic acid
InChI:
InChI=1S/C11H18BNO2/c1-3-13(4-2)9-10-6-5-7-11(8-10)12(14)15/h5-8,14-15H,3-4,9H2,1-2H3
InChI Key:
LVIMXKVETPNUMR-UHFFFAOYSA-N
SMILES:
CCN(Cc1cccc(c1)B(O)O)CC
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.143g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.08g/mol
Monoisotopic Mass:
207.143g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties