Name: Name:methyl 4-bromo-1-(2-chloroacetimidamido)-1H-pyrrole-2-carboxylate
Brand: Angene
SKU: AG01DJ9C
Rating: 90 (10 reviews)

methyl 4-bromo-1-(2-chloroacetimidamido)-1H-pyrrole-2-carboxylate

CAS No.:

1956426-79-1

Catalog Number:

AG01DJ9C

Molecular Formula:

C8H9BrClN3O2

Molecular Weight:

294.5330

Catalog Number:

AG01DJ9C

Chemical Name:

methyl 4-bromo-1-(2-chloroacetimidamido)-1H-pyrrole-2-carboxylate

CAS Number:

1956426-79-1

Molecular Formula:

C8H9BrClN3O2

Molecular Weight:

294.5330

MDL Number:

MFCD28991813

IUPAC Name:

methyl 1-[(1-amino-2-chloroethylidene)amino]-4-bromopyrrole-2-carboxylate

InChI:

InChI=1S/C8H9BrClN3O2/c1-15-8(14)6-2-5(9)4-13(6)12-7(11)3-10/h2,4H,3H2,1H3,(H2,11,12)

InChI Key:

YBERFBBKPFOVCJ-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(cn1NC(=N)CCl)Br

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

292.957g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

294.533g/mol

Monoisotopic Mass:

292.957g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7