Name: Name:1-benzyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG019P4T
Rating: 90 (10 reviews)

1-benzyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde

CAS No.:

956438-63-4

Catalog Number:

AG019P4T

Molecular Formula:

C15H12N2OS

Molecular Weight:

268.3336

Catalog Number:

AG019P4T

Chemical Name:

1-benzyl-3-(thiophen-2-yl)-1H-pyrazole-4-carbaldehyde

CAS Number:

956438-63-4

Molecular Formula:

C15H12N2OS

Molecular Weight:

268.3336

MDL Number:

MFCD07343848

IUPAC Name:

1-benzyl-3-thiophen-2-ylpyrazole-4-carbaldehyde

InChI:

InChI=1S/C15H12N2OS/c18-11-13-10-17(9-12-5-2-1-3-6-12)16-15(13)14-7-4-8-19-14/h1-8,10-11H,9H2

InChI Key:

VLKYAOHVKGPROV-UHFFFAOYSA-N

SMILES:

O=Cc1cn(nc1c1cccs1)Cc1ccccc1

Complexity:

307

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

268.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

268.334g/mol

Monoisotopic Mass:

268.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7