Name: Name:1H-Pyrrole-3-carboxaldehyde, 1-(4-chlorophenyl)-2,5-dimethyl-
Brand: Angene
SKU: AG0029M6
Rating: 90 (10 reviews)

1H-Pyrrole-3-carboxaldehyde, 1-(4-chlorophenyl)-2,5-dimethyl-

CAS No.:

20461-26-1

Catalog Number:

AG0029M6

Molecular Formula:

C13H12ClNO

Molecular Weight:

233.6935

Catalog Number:

AG0029M6

Chemical Name:

1H-Pyrrole-3-carboxaldehyde, 1-(4-chlorophenyl)-2,5-dimethyl-

CAS Number:

20461-26-1

Molecular Formula:

C13H12ClNO

Molecular Weight:

233.6935

MDL Number:

MFCD02212595

IUPAC Name:

1-(4-chlorophenyl)-2,5-dimethylpyrrole-3-carbaldehyde

InChI:

InChI=1S/C13H12ClNO/c1-9-7-11(8-16)10(2)15(9)13-5-3-12(14)4-6-13/h3-8H,1-2H3

InChI Key:

CEMZCIWXACIVOA-UHFFFAOYSA-N

SMILES:

O=Cc1cc(n(c1C)c1ccc(cc1)Cl)C

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.695g/mol

Monoisotopic Mass:

233.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

22A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2