Name: Name:ethyl 3-(4-bromo-1H-pyrazol-1-yl)-2-methylpropanoate
Brand: Angene
SKU: AG019TA7
Rating: 90 (10 reviews)

ethyl 3-(4-bromo-1H-pyrazol-1-yl)-2-methylpropanoate

CAS No.:

1249644-53-8

Catalog Number:

AG019TA7

Molecular Formula:

C9H13BrN2O2

Molecular Weight:

261.1157

Catalog Number:

AG019TA7

Chemical Name:

ethyl 3-(4-bromo-1H-pyrazol-1-yl)-2-methylpropanoate

CAS Number:

1249644-53-8

Molecular Formula:

C9H13BrN2O2

Molecular Weight:

261.1157

MDL Number:

MFCD16087643

IUPAC Name:

ethyl 3-(4-bromopyrazol-1-yl)-2-methylpropanoate

InChI:

InChI=1S/C9H13BrN2O2/c1-3-14-9(13)7(2)5-12-6-8(10)4-11-12/h4,6-7H,3,5H2,1-2H3

InChI Key:

CLUUHVDXYKMKKW-UHFFFAOYSA-N

SMILES:

CC(C(=O)OCC)Cn1cc(cn1)Br

Complexity:

201

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

260.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.119g/mol

Monoisotopic Mass:

260.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6