Name: Name:ethyl 4-amino-3-bromo-1H-pyrazole-5-carboxylate
Brand: Angene
SKU: AG01E9JK
Rating: 90 (10 reviews)

ethyl 4-amino-3-bromo-1H-pyrazole-5-carboxylate

CAS No.:

1979126-28-7

Catalog Number:

AG01E9JK

Molecular Formula:

C6H8BrN3O2

Molecular Weight:

234.0506

Catalog Number:

AG01E9JK

Chemical Name:

ethyl 4-amino-3-bromo-1H-pyrazole-5-carboxylate

CAS Number:

1979126-28-7

Molecular Formula:

C6H8BrN3O2

Molecular Weight:

234.0506

MDL Number:

MFCD29761657

IUPAC Name:

ethyl 4-amino-5-bromo-1H-pyrazole-3-carboxylate

InChI:

InChI=1S/C6H8BrN3O2/c1-2-12-6(11)4-3(8)5(7)10-9-4/h2,8H2,1H3,(H,9,10)

InChI Key:

ILCPMHDLWQWUDN-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(N)c(n[nH]1)Br

Complexity:

178

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.98g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.053g/mol

Monoisotopic Mass:

232.98g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7