Name: Name:1H-Pyrazole-3-carboxaldehyde,5-(2-furanyl)-1-methyl-
Brand: Angene
SKU: AG004NZY
Rating: 90 (10 reviews)

1H-Pyrazole-3-carboxaldehyde,5-(2-furanyl)-1-methyl-

CAS No.:

876728-40-4

Catalog Number:

AG004NZY

Molecular Formula:

C9H8N2O2

Molecular Weight:

176.1720

Catalog Number:

AG004NZY

Chemical Name:

1H-Pyrazole-3-carboxaldehyde,5-(2-furanyl)-1-methyl-

CAS Number:

876728-40-4

Molecular Formula:

C9H8N2O2

Molecular Weight:

176.1720

MDL Number:

MFCD08271947

IUPAC Name:

5-(furan-2-yl)-1-methylpyrazole-3-carbaldehyde

InChI:

InChI=1S/C9H8N2O2/c1-11-8(5-7(6-12)10-11)9-3-2-4-13-9/h2-6H,1H3

InChI Key:

KKYBQGWJSPHUED-UHFFFAOYSA-N

SMILES:

O=Cc1nn(c(c1)c1ccco1)C

Complexity:

198

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.175g/mol

Monoisotopic Mass:

176.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

48A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8