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Home > Boronic Acids > 1122568-12-0
1122568-12-0 | 2-(3-Methoxypropoxy)phenylboronic acid
CAS No: 1122568-12-0 Catalog No: AG00941A MDL No:MFCD12768318
Product Description
Catalog Number:
AG00941A
Chemical Name:
2-(3-Methoxypropoxy)phenylboronic acid
CAS Number:
1122568-12-0
Molecular Formula:
C10H15BO4
Molecular Weight:
210.0347
MDL Number:
MFCD12768318
IUPAC Name:
[2-(3-methoxypropoxy)phenyl]boronic acid
InChI:
InChI=1S/C10H15BO4/c1-14-7-4-8-15-10-6-3-2-5-9(10)11(12)13/h2-3,5-6,12-13H,4,7-8H2,1H3
InChI Key:
QTKSGDCKQYSRMK-UHFFFAOYSA-N
SMILES:
COCCCOc1ccccc1B(O)O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.036g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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