(S)-2-[[3,5-Bis(trifluoromethyl)phenyl]thioureido]-N-benzyl-N,3,3-trimethylbutanamide - 97%, high purity , CAS No.959979-30-7

  • ≥97%
Item Number
S281590
Grouped product items
SKUSizeAvailabilityPrice Qty
S281590-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$86.90
S281590-250mg
250mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$267.90

Discover (S)-2-[[3,5-Bis(trifluoromethyl)phenyl]thioureido]-N-benzyl-N,3,3-trimethylbutanamide by Aladdin Scientific in 97% for only $86.90. Available - in Ligands at Aladdin Scientific. Catalysts & Chiral Catalysts Tags: 4686.

Basic Description

Synonyms(S)-2-[[3,5-Bis(trifluoromethyl)phenyl]thioureido]-N-benzyl-N,3,3-trimethylbutanamide, 97% | AKOS037651412 | doi:10.14272/LTFFYVVCUVYZPE-GOSISDBHSA-N.1 | CS-16868 | CS-B0761 | D77218 | MFCD10567031 | N-Benzyl-N~2~-{[3,5-bis(trifluoromethyl)phenyl]carbamot
Specifications & Purity97%
Storage TempStore at 2-8°C,Protected from light,Argon charged
Shipped InWet ice

Names and Identifiers

IUPAC Name (2S)-N-benzyl-2-[[3,5-bis(trifluoromethyl)phenyl]carbamothioylamino]-N,3,3-trimethylbutanamide
INCHI InChI=1S/C23H25F6N3OS/c1-21(2,3)18(19(33)32(4)13-14-8-6-5-7-9-14)31-20(34)30-17-11-15(22(24,25)26)10-16(12-17)23(27,28)29/h5-12,18H,13H2,1-4H3,(H2,30,31,34)/t18-/m1/s1
InChi Key LTFFYVVCUVYZPE-GOSISDBHSA-N
Canonical SMILES CC(C)(C)C(C(=O)N(C)CC1=CC=CC=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
Isomeric SMILES CC(C)(C)[C@@H](C(=O)N(C)CC1=CC=CC=C1)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
PubChem CID 44541120
Molecular Weight 505.52

Certificates

Certificate of Analysis(COA)

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3 results found

Lot NumberCertificate TypeDateItem
B2421349Certificate of AnalysisJan 11, 2024 S281590
B2421350Certificate of AnalysisJan 11, 2024 S281590
B2421351Certificate of AnalysisJan 11, 2024 S281590

Chemical and Physical Properties

Specific Rotation[α][α]20/D -57.0°, c = 1 in chloroform
Melt Point(°C)147-152 °C

Safety and Hazards(GHS)

Pictogram(s) GHS07
Signal Warning
Hazard Statements

H315:Causes skin irritation

H319:Causes serious eye irritation

H335:May cause respiratory irritation

H413:May cause long lasting harmful effects to aquatic life

H302:Harmful if swallowed

H312:Harmful in contact with skin

Precautionary Statements

P261:Avoid breathing dust/fume/gas/mist/vapors/spray.

P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing.

P273:Avoid release to the environment.

P280:Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352:IF ON SKIN: wash with plenty of water.

P321:Specific treatment (see ... on this label).

P405:Store locked up.

P501:Dispose of contents/container to ...

P264:Wash hands [and …] thoroughly after handling.

P271:Use only outdoors or in a well-ventilated area.

P270:Do not eat, drink or smoke when using this product.

P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P403+P233:Store in a well-ventilated place. Keep container tightly closed.

P362+P364:Take off contaminated clothing and wash it before reuse.

P330:Rinse mouth.

P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes.

P301+P317:IF SWALLOWED: Get medical help.

P317:Get emergency medical help.

P337+P317:If eye irritation persists: Get medical help.

P332+P317:If skin irritation occurs: Get medical help.

P319:Get medical help if you feel unwell.

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