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Home > Boronic Acids > 200204-95-1
200204-95-1 | Boronic acid, [5-(methoxymethyl)-3-pyridinyl]- (9CI)
CAS No: 200204-95-1 Catalog No: AG002CMI MDL No:MFCD09952044
Product Description
Catalog Number:
AG002CMI
Chemical Name:
Boronic acid, [5-(methoxymethyl)-3-pyridinyl]- (9CI)
CAS Number:
200204-95-1
Molecular Formula:
C7H10BNO3
Molecular Weight:
166.9702
MDL Number:
MFCD09952044
IUPAC Name:
[5-(methoxymethyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C7H10BNO3/c1-12-5-6-2-7(8(10)11)4-9-3-6/h2-4,10-11H,5H2,1H3
InChI Key:
LCICXPYHZCXDJY-UHFFFAOYSA-N
SMILES:
COCc1cncc(c1)B(O)O
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.971g/mol
Monoisotopic Mass:
167.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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