Home Halogens 2-[(6-bromonaphthalen-2-yl)oxy]acetic acid

2-[(6-bromonaphthalen-2-yl)oxy]acetic acid

CAS No.:
141791-36-8
Catalog Number:
AG019V4N
Molecular Formula:
C12H9BrO3
Molecular Weight:
281.1021
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Product Description
Catalog Number:
AG019V4N
Chemical Name:
2-[(6-bromonaphthalen-2-yl)oxy]acetic acid
CAS Number:
141791-36-8
Molecular Formula:
C12H9BrO3
Molecular Weight:
281.1021
MDL Number:
MFCD06260704
IUPAC Name:
2-(6-bromonaphthalen-2-yl)oxyacetic acid
InChI:
InChI=1S/C12H9BrO3/c13-10-3-1-9-6-11(16-7-12(14)15)4-2-8(9)5-10/h1-6H,7H2,(H,14,15)
InChI Key:
PYKIQIUJEIDVFD-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc2c(c1)ccc(c2)Br
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.974g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.105g/mol
Monoisotopic Mass:
279.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties