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Home > Boronic Acids > 160061-48-3
160061-48-3 | Boronic acid, [4-(propoxymethyl)phenyl]- (9CI)
CAS No: 160061-48-3 Catalog No: AG001RMZ MDL No:MFCD14687314
Product Description
Catalog Number:
AG001RMZ
Chemical Name:
Boronic acid, [4-(propoxymethyl)phenyl]- (9CI)
CAS Number:
160061-48-3
Molecular Formula:
C10H15BO3
Molecular Weight:
194.0353
MDL Number:
MFCD14687314
IUPAC Name:
[4-(propoxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C10H15BO3/c1-2-7-14-8-9-3-5-10(6-4-9)11(12)13/h3-6,12-13H,2,7-8H2,1H3
InChI Key:
WZSZSIRDVBCIQM-UHFFFAOYSA-N
SMILES:
CCCOCc1ccc(cc1)B(O)O
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.037g/mol
Monoisotopic Mass:
194.111g/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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