4-(Trifluoromethyl)-2-thiazolamine

C4H3F3N2SCAS 349-49-5168.14 g/mol

Open in Covalent MOL file
HNHNFFFS
Alkyl halide

Properties

Molecular formula
C4H3F3N2S
Molar mass
168.14 g/mol
Exact mass
167.9969 Da
Melting point
58–60 °C
Boiling point
110–114 °C (at 9 Torr)
logP
1.57Crippen estimate
Polar surface area
39.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number
349-49-5
SMILES
N=c1[nH]c(C(F)(F)F)cs1
InChIKey
OVMGTNMCYLZGLS-UHFFFAOYSA-N
InChI
InChI=1S/C4H3F3N2S/c5-4(6,7)2-1-10-3(8)9-2/h1H,(H2,8,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • 2-Thiazolamine, 4-(trifluoromethyl)-
  • Thiazole, 2-amino-4-(trifluoromethyl)-
  • 2-Amino-4-trifluoromethylthiazole
  • 4-Trifluoromethyl-2-aminothiazole
  • 2-Amino-4-trifluoromethyl-1,3-thiazole
  • 4-(Trifluoromethyl)thiazol-2-amine
  • 4-(Trifluoromethyl)-1,3-thiazol-2-amine
  • (4-Trifluoromethylthiazol-2-yl)amine

Work with 4-(Trifluoromethyl)-2-thiazolamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Amino-4-methylthiazole1603-91-443 % similar 2-Amino-4-methylthiazole hydrochloride6142-15-039 % similar 2-Amino-4-phenylthiazole2010-06-238 % similar 2-Amino-4-thiazoleacetic acid29676-71-938 % similar 4-[1,1′-Biphenyl]-4-yl-2-thiazolamine2834-79-936 % similar 4-(Chloromethyl)-2-thiazolamine hydrochloride59608-97-836 % similar 5-(Trifluoromethyl)-1,3,4-thiadiazol-2-amine10444-89-035 % similar 4-(4-Chlorophenyl)-2-thiazolamine2103-99-335 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-(Trifluoromethyl)thiazol-2-amine169260-97-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook