Name: Name:4-[2-Chloro-5-(trifluoromethyl)phenyl]-3-thiosemicarbazide
Brand: Angene
SKU: AG002IK7
Rating: 90 (10 reviews)

4-[2-Chloro-5-(trifluoromethyl)phenyl]-3-thiosemicarbazide

CAS No.:

206559-51-5

Catalog Number:

AG002IK7

Molecular Formula:

C8H7ClF3N3S

Molecular Weight:

269.6745

Catalog Number:

AG002IK7

Chemical Name:

4-[2-Chloro-5-(trifluoromethyl)phenyl]-3-thiosemicarbazide

CAS Number:

206559-51-5

Molecular Formula:

C8H7ClF3N3S

Molecular Weight:

269.6745

MDL Number:

MFCD00041274

IUPAC Name:

1-amino-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea

InChI:

InChI=1S/C8H7ClF3N3S/c9-5-2-1-4(8(10,11)12)3-6(5)14-7(16)15-13/h1-3H,13H2,(H2,14,15,16)

InChI Key:

MXGYRNPXMHSZKJ-UHFFFAOYSA-N

SMILES:

NNC(=S)Nc1cc(ccc1Cl)C(F)(F)F

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.67g/mol

Monoisotopic Mass:

269g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3