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Home > Boronic Acids > 1313761-41-9
1313761-41-9 | [2-(2-phenylethoxy)phenyl]boronic acid
CAS No: 1313761-41-9 Catalog No: AG01AHPK MDL No:MFCD11540647
Product Description
Catalog Number:
AG01AHPK
Chemical Name:
[2-(2-phenylethoxy)phenyl]boronic acid
CAS Number:
1313761-41-9
Molecular Formula:
C14H15BO3
Molecular Weight:
242.0781
MDL Number:
MFCD11540647
IUPAC Name:
[2-(2-phenylethoxy)phenyl]boronic acid
InChI:
InChI=1S/C14H15BO3/c16-15(17)13-8-4-5-9-14(13)18-11-10-12-6-2-1-3-7-12/h1-9,16-17H,10-11H2
InChI Key:
DSHRJFXNRCHYTE-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1OCCc1ccccc1)O
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.081g/mol
Monoisotopic Mass:
242.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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