Name: Name:2,5-dimethyl-1-(2,3,4-trifluorophenyl)-1H-pyrrole-3-carbaldehyde
Brand: Angene
SKU: AG00IH4B
Rating: 90 (10 reviews)

2,5-dimethyl-1-(2,3,4-trifluorophenyl)-1H-pyrrole-3-carbaldehyde

CAS No.:

923832-17-1

Catalog Number:

AG00IH4B

Molecular Formula:

C13H10F3NO

Molecular Weight:

253.2198

Catalog Number:

AG00IH4B

Chemical Name:

2,5-dimethyl-1-(2,3,4-trifluorophenyl)-1H-pyrrole-3-carbaldehyde

CAS Number:

923832-17-1

Molecular Formula:

C13H10F3NO

Molecular Weight:

253.2198

MDL Number:

MFCD08445070

IUPAC Name:

2,5-dimethyl-1-(2,3,4-trifluorophenyl)pyrrole-3-carbaldehyde

InChI:

InChI=1S/C13H10F3NO/c1-7-5-9(6-18)8(2)17(7)11-4-3-10(14)12(15)13(11)16/h3-6H,1-2H3

InChI Key:

ZKNITCGSHSEZJE-UHFFFAOYSA-N

SMILES:

O=Cc1cc(n(c1C)c1ccc(c(c1F)F)F)C

Complexity:

315

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.224g/mol

Monoisotopic Mass:

253.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

22A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9