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Home > Boronic Acids > 874459-75-3
874459-75-3 | (4-(2-Acetamidoethyl);phenyl);boronic acid
CAS No: 874459-75-3 Catalog No: AG004IY0 MDL No:MFCD09878326
Product Description
Catalog Number:
AG004IY0
Chemical Name:
(4-(2-Acetamidoethyl);phenyl);boronic acid
CAS Number:
874459-75-3
Molecular Formula:
C10H14BNO3
Molecular Weight:
207.0341
MDL Number:
MFCD09878326
IUPAC Name:
[4-(2-acetamidoethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BNO3/c1-8(13)12-7-6-9-2-4-10(5-3-9)11(14)15/h2-5,14-15H,6-7H2,1H3,(H,12,13)
InChI Key:
MASBKHYFMNIEKU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)CCNC(=O)C)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:
207.107g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
207.036g/mol
Monoisotopic Mass:
207.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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