Name: Name:Methyl 4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate
Brand: Angene
SKU: AG0099V6
Rating: 90 (10 reviews)

Methyl 4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

CAS No.:

1207518-63-5

Catalog Number:

AG0099V6

Molecular Formula:

C8H6ClN3O2

Molecular Weight:

211.6051

Catalog Number:

AG0099V6

Chemical Name:

Methyl 4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

CAS Number:

1207518-63-5

Molecular Formula:

C8H6ClN3O2

Molecular Weight:

211.6051

MDL Number:

MFCD17016053

IUPAC Name:

methyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

InChI:

InChI=1S/C8H6ClN3O2/c1-14-8(13)4-2-10-7-5(4)6(9)11-3-12-7/h2-3H,1H3,(H,10,11,12)

InChI Key:

BFUCSJAQMGZHOP-UHFFFAOYSA-N

SMILES:

COC(=O)c1c[nH]c2c1c(Cl)ncn2

Complexity:

239

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

211.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

211.605g/mol

Monoisotopic Mass:

211.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5