Name: Name:METHYL 4-CHLORO-7-METHYL-7H-PYRROLO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
Brand: Angene
SKU: AG01DV53
Rating: 90 (10 reviews)

METHYL 4-CHLORO-7-METHYL-7H-PYRROLO[2,3-D]PYRIMIDINE-6-CARBOXYLATE

CAS No.:

1260663-57-7

Catalog Number:

AG01DV53

Molecular Formula:

C9H8ClN3O2

Molecular Weight:

225.6317

Catalog Number:

AG01DV53

Chemical Name:

METHYL 4-CHLORO-7-METHYL-7H-PYRROLO[2,3-D]PYRIMIDINE-6-CARBOXYLATE

CAS Number:

1260663-57-7

Molecular Formula:

C9H8ClN3O2

Molecular Weight:

225.6317

MDL Number:

MFCD18250577

IUPAC Name:

methyl 4-chloro-7-methylpyrrolo[2,3-d]pyrimidine-6-carboxylate

InChI:

InChI=1S/C9H8ClN3O2/c1-13-6(9(14)15-2)3-5-7(10)11-4-12-8(5)13/h3-4H,1-2H3

InChI Key:

CQKNGJFYCSWIRI-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2c(n1C)ncnc2Cl

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.632g/mol

Monoisotopic Mass:

225.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8