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N-[(1R,2R)-2-Amino-1,2-diphenylethyl]-N'-[3,5-bis(trifluoromethyl)phenyl]thiourea - 98%, high purity , CAS No.1088705-53-6
Catalysts & Chiral Catalysts
Basic Description
Synonyms | 1-((1R,2R)-2-Amino-1,2-diphenylethyl)-3-(3,5-bis(trifluoromethyl)phenyl)thiourea |
Specifications & Purity | ≥98% |
Legal Information | Sold in collaboration with Daicel for research purposes only. |
Storage Temp | Store at 2-8°C,Argon charged |
Shipped In | Wet ice |
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Names and Identifiers
IUPAC Name | 1-[(1R,2R)-2-amino-1,2-diphenylethyl]-3-[3,5-bis(trifluoromethyl)phenyl]thiourea |
INCHI | InChI=1S/C23H19F6N3S/c24-22(25,26)16-11-17(23(27,28)29)13-18(12-16)31-21(33)32-20(15-9-5-2-6-10-15)19(30)14-7-3-1-4-8-14/h1-13,19-20H,30H2,(H2,31,32,33)/t19-,20-/m1/s1 |
InChi Key | IYOXSNQTLZTQFG-WOJBJXKFSA-N |
Canonical SMILES | S=C(N[C@@H]([C@@H](c1ccccc1)N)c1ccccc1)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |
Isomeric SMILES | C1=CC=C(C=C1)[C@H]([C@@H](C2=CC=CC=C2)NC(=S)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N |
PubChem CID | 49794471 |
Molecular Weight | 483.47 |
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Chemical and Physical Properties
Specific Rotation[α] | +13.5°, ( c=1.0 in chloroform) |
Melt Point(°C) | 91-93°C |
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Safety and Hazards(GHS)
Signal | Warning |
Hazard Statements | H413:May cause long lasting harmful effects to aquatic life H302:Harmful if swallowed |
Precautionary Statements | P264:Wash hands [and …] thoroughly after handling. P270:Do not eat, drink or smoke when using this product. P301+P312:IF SWALLOWED: call a POISON CENTER/doctor/... IF you feel unwell. |
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