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Home > Boronic Acids > 849062-10-8
849062-10-8 | (2-(((5,6,7,8-Tetrahydronaphthalen-1-yl)oxy)methyl)phenyl)boronic acid
CAS No: 849062-10-8 Catalog No: AG003BJW MDL No:MFCD07369757
Product Description
Catalog Number:
AG003BJW
Chemical Name:
(2-(((5,6,7,8-Tetrahydronaphthalen-1-yl)oxy)methyl)phenyl)boronic acid
CAS Number:
849062-10-8
Molecular Formula:
C17H19BO3
Molecular Weight:
282.1420
MDL Number:
MFCD07369757
IUPAC Name:
[2-(5,6,7,8-tetrahydronaphthalen-1-yloxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C17H19BO3/c19-18(20)16-10-4-2-7-14(16)12-21-17-11-5-8-13-6-1-3-9-15(13)17/h2,4-5,7-8,10-11,19-20H,1,3,6,9,12H2
InChI Key:
KTXSKKVFEAGKEZ-UHFFFAOYSA-N
SMILES:
OB(c1ccccc1COc1cccc2c1CCCC2)O
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.146g/mol
Monoisotopic Mass:
282.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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