Name: Name:methyl 3-(1-methyl-1H-pyrazol-4-yl)but-2-enoate
Brand: Angene
SKU: AG01AN5O
Rating: 90 (10 reviews)

methyl 3-(1-methyl-1H-pyrazol-4-yl)but-2-enoate

CAS No.:

1563987-77-8

Catalog Number:

AG01AN5O

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

Catalog Number:

AG01AN5O

Chemical Name:

methyl 3-(1-methyl-1H-pyrazol-4-yl)but-2-enoate

CAS Number:

1563987-77-8

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

MDL Number:

MFCD29034161

IUPAC Name:

methyl 3-(1-methylpyrazol-4-yl)but-2-enoate

InChI:

InChI=1S/C9H12N2O2/c1-7(4-9(12)13-3)8-5-10-11(2)6-8/h4-6H,1-3H3

InChI Key:

GWRFPWBJPIIFSA-UHFFFAOYSA-N

SMILES:

COC(=O)C=C(c1cnn(c1)C)C

Complexity:

226

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.207g/mol

Monoisotopic Mass:

180.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1