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Home > Boronic Acids > 216443-40-2
216443-40-2 | (3-(Methoxymethoxy);phenyl);boronic acid
CAS No: 216443-40-2 Catalog No: AG007PO0 MDL No:MFCD11040407
Product Description
Catalog Number:
AG007PO0
Chemical Name:
(3-(Methoxymethoxy);phenyl);boronic acid
CAS Number:
216443-40-2
Molecular Formula:
C8H11BO4
Molecular Weight:
181.9815
MDL Number:
MFCD11040407
IUPAC Name:
[3-(methoxymethoxy)phenyl]boronic acid
InChI:
InChI=1S/C8H11BO4/c1-12-6-13-8-4-2-3-7(5-8)9(10)11/h2-5,10-11H,6H2,1H3
InChI Key:
VAPXDSYOTCGWBV-UHFFFAOYSA-N
SMILES:
COCOc1cccc(c1)B(O)O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.982g/mol
Monoisotopic Mass:
182.075g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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