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65271-84-3

65271-84-3 | Benzoic acid, 2-(3-pyridazinyloxy)-

CAS No: 65271-84-3 Catalog No: AG00H65X MDL No:

Product Description

Catalog Number:
AG00H65X
Chemical Name:
Benzoic acid, 2-(3-pyridazinyloxy)-
CAS Number:
65271-84-3
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
IUPAC Name:
2-pyridazin-3-yloxybenzoic acid
InChI:
InChI=1S/C11H8N2O3/c14-11(15)8-4-1-2-5-9(8)16-10-6-3-7-12-13-10/h1-7H,(H,14,15)
InChI Key:
DQHFPXUQVFOSRZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1Oc1cccnn1

Properties

Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.196g/mol
Monoisotopic Mass:
216.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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