Name: Name:methyl 3-chloro-5H,6H,7H-cyclopenta[c]pyridazine-4-carboxylate
Brand: Angene
SKU: AG01DZ99
Rating: 90 (10 reviews)

methyl 3-chloro-5H,6H,7H-cyclopenta[c]pyridazine-4-carboxylate

CAS No.:

2091710-34-6

Catalog Number:

AG01DZ99

Molecular Formula:

C9H9ClN2O2

Molecular Weight:

212.6330

Catalog Number:

AG01DZ99

Chemical Name:

methyl 3-chloro-5H,6H,7H-cyclopenta[c]pyridazine-4-carboxylate

CAS Number:

2091710-34-6

Molecular Formula:

C9H9ClN2O2

Molecular Weight:

212.6330

MDL Number:

MFCD31615918

IUPAC Name:

methyl 3-chloro-6,7-dihydro-5H-cyclopenta[c]pyridazine-4-carboxylate

InChI:

InChI=1S/C9H9ClN2O2/c1-14-9(13)7-5-3-2-4-6(5)11-12-8(7)10/h2-4H2,1H3

InChI Key:

RZDZFVGCJDGSLT-UHFFFAOYSA-N

SMILES:

COC(=O)c1c(Cl)nnc2c1CCC2

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.633g/mol

Monoisotopic Mass:

212.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3