Home Carboxys 6-Chloro-pyridazine-4-carboxylic acid ethyl ester

6-Chloro-pyridazine-4-carboxylic acid ethyl ester

CAS No.:
612834-90-9
Catalog Number:
AG00EIGA
Molecular Formula:
C7H7ClN2O2
Molecular Weight:
186.5957
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Product Description
Catalog Number:
AG00EIGA
Chemical Name:
6-Chloro-pyridazine-4-carboxylic acid ethyl ester
CAS Number:
612834-90-9
Molecular Formula:
C7H7ClN2O2
Molecular Weight:
186.5957
MDL Number:
MFCD18205955
IUPAC Name:
ethyl 6-chloropyridazine-4-carboxylate
InChI:
InChI=1S/C7H7ClN2O2/c1-2-12-7(11)5-3-6(8)10-9-4-5/h3-4H,2H2,1H3
InChI Key:
DZSYDSVXAOQGNB-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnnc(c1)Cl
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.595g/mol
Monoisotopic Mass:
186.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties