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Home > Boronic Acids > 1401222-65-8
1401222-65-8 | 4-(1,3-Dioxolan-2-yl)phenylboronic Acid
CAS No: 1401222-65-8 Catalog No: AG00J7QR MDL No:MFCD26401984
Product Description
Catalog Number:
AG00J7QR
Chemical Name:
4-(1,3-Dioxolan-2-yl)phenylboronic Acid
CAS Number:
1401222-65-8
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
MDL Number:
MFCD26401984
IUPAC Name:
[4-(1,3-dioxolan-2-yl)phenyl]boronic acid
InChI:
InChI=1S/C9H11BO4/c11-10(12)8-3-1-7(2-4-8)9-13-5-6-14-9/h1-4,9,11-12H,5-6H2
InChI Key:
MMXMNBDFQFTNRT-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C1OCCO1)O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.993g/mol
Monoisotopic Mass:
194.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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