Name: Name:3-chloro-5-cyclopropyl-4-(4-fluorophenyl)-4H-1,2,4-triazole
Brand: Angene
SKU: AG019MQX
Rating: 90 (10 reviews)

3-chloro-5-cyclopropyl-4-(4-fluorophenyl)-4H-1,2,4-triazole

CAS No.:

1087792-20-8

Catalog Number:

AG019MQX

Molecular Formula:

C11H9ClFN3

Molecular Weight:

237.6607

Catalog Number:

AG019MQX

Chemical Name:

3-chloro-5-cyclopropyl-4-(4-fluorophenyl)-4H-1,2,4-triazole

CAS Number:

1087792-20-8

Molecular Formula:

C11H9ClFN3

Molecular Weight:

237.6607

MDL Number:

MFCD11099474

IUPAC Name:

3-chloro-5-cyclopropyl-4-(4-fluorophenyl)-1,2,4-triazole

InChI:

InChI=1S/C11H9ClFN3/c12-11-15-14-10(7-1-2-7)16(11)9-5-3-8(13)4-6-9/h3-7H,1-2H2

InChI Key:

YLMNNHFAOPOZIJ-UHFFFAOYSA-N

SMILES:

Fc1ccc(cc1)n1c(Cl)nnc1C1CC1

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.047g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

237.662g/mol

Monoisotopic Mass:

237.047g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7