Name: Name:1-(3-chloro-4-fluorophenyl)-1H-1,2,3-triazole-4-carbaldehyde
Brand: Angene
SKU: AG01A60L
Rating: 90 (10 reviews)

1-(3-chloro-4-fluorophenyl)-1H-1,2,3-triazole-4-carbaldehyde

CAS No.:

1461708-00-8

Catalog Number:

AG01A60L

Molecular Formula:

C9H5ClFN3O

Molecular Weight:

225.6069

Catalog Number:

AG01A60L

Chemical Name:

1-(3-chloro-4-fluorophenyl)-1H-1,2,3-triazole-4-carbaldehyde

CAS Number:

1461708-00-8

Molecular Formula:

C9H5ClFN3O

Molecular Weight:

225.6069

MDL Number:

MFCD21715544

IUPAC Name:

1-(3-chloro-4-fluorophenyl)triazole-4-carbaldehyde

InChI:

InChI=1S/C9H5ClFN3O/c10-8-3-7(1-2-9(8)11)14-4-6(5-15)12-13-14/h1-5H

InChI Key:

PUVYYKRBWGZANM-UHFFFAOYSA-N

SMILES:

O=Cc1nnn(c1)c1ccc(c(c1)Cl)F

Complexity:

243

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.011g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.607g/mol

Monoisotopic Mass:

225.011g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9