670731
(S)-α,α-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol
≥99% (HPLC)
Manufacturer: Sigma Aldrich
CAS Number: 131180-63-7
Synonym(S): (S)-(−)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
Select a Size
| Pack Size | SKU | Availability | Price |
|---|---|---|---|
| 500 MG | 670731-500-MG | In Stock | ₹ 10,050.00 |
670731 - 500 MG
In Stock
Quantity
1
Base Price: ₹ 10,050.00
GST (18%): ₹ 1,809.00
Total Price: ₹ 11,859.00
Assay
≥99% (HPLC)
optical purity
enantiomeric ratio: 97.5% (HPLC)
mp
98-101 °C
storage temp.
2-8°C
SMILES string
Cc1cc(C)cc(c1)C(O)([C@@H]2CCCN2)c3cc(C)cc(C)c3
InChI
1S/C21H27NO/c1-14-8-15(2)11-18(10-14)21(23,20-6-5-7-22-20)19-12-16(3)9-17(4)13-19/h8-13,20,22-23H,5-7H2,1-4H3/t20-/m0/s1
InChI key
MXIOBZPVLNQGIU-FQEVSTJZSA-N
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 131180-63-7 | (S)-Alpha,alpha-bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol | A2B Chem | ₹ 1,026.72 - ₹ 28,234.80 |
Related Products
Description
- Application: (S)-α,α-Bis(3,5-dimethylphenyl)-2-pyrrolidinemethanol can be used as: A chiral organocatalyst in the preparation of α-[(phenyl)methyl]thio]alkanal derivatives using aldehydes as starting materials and [(phenyl)methyl]thio]triazole as a sulfur electrophile.[1] A catalyst in the preparation of chiral bipyrazolidin-3-one derivatives by cycloadditions of azomethine imines with α,β-unsaturated aldehydes.[2]
SAFETY INFORMATION
Pictograms
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Acute 1
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Compare Similar Items
Show Difference
Assay: ≥99% (HPLC)
optical purity: enantiomeric ratio: 97.5% (HPLC)
mp: 98-101 °C
storage temp.: 2-8°C
SMILES string: Cc1cc(C)cc(c1)C(O)([C@@H]2CCCN2)c3cc(C)cc(C)c3
InChI: 1S/C21H27NO/c1-14-8-15(2)11-18(10-14)21(23,20-6-5-7-22-20)19-12-16(3)9-17(4)13-19/h8-13,20,22-23H,5-7H2,1-4H3/t20-/m0/s1
InChI key: MXIOBZPVLNQGIU-FQEVSTJZSA-N
Assay:
≥99% (HPLC)
optical purity:
enantiomeric ratio: 97.5% (HPLC)
mp:
98-101 °C
storage temp.:
2-8°C
SMILES string:
Cc1cc(C)cc(c1)C(O)([C@@H]2CCCN2)c3cc(C)cc(C)c3
InChI:
1S/C21H27NO/c1-14-8-15(2)11-18(10-14)21(23,20-6-5-7-22-20)19-12-16(3)9-17(4)13-19/h8-13,20,22-23H,5-7H2,1-4H3/t20-/m0/s1
InChI key:
MXIOBZPVLNQGIU-FQEVSTJZSA-N
Assay: ≥98.0% (TLC)
optical purity: __
mp: __
storage temp.: __
SMILES string: CCCCCCCCCCCCCCCC(=O)N[C@@H](CSCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C(O)=O
InChI: 1S/C54H103NO7S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-51(56)55-50(54(59)60)48-63-47-49(62-53(58)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)46-61-52(57)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h49-50H,4-48H2,1-3H3,(H,55,56)(H,59,60)/t49?,50-/m0/s1
InChI key: PZFZLRNAOHUQPH-GOOVXGPGSA-N
Assay:
≥98.0% (TLC)
optical purity:
__
mp:
__
storage temp.:
__
SMILES string:
CCCCCCCCCCCCCCCC(=O)N[C@@H](CSCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C(O)=O
InChI:
1S/C54H103NO7S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-51(56)55-50(54(59)60)48-63-47-49(62-53(58)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)46-61-52(57)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h49-50H,4-48H2,1-3H3,(H,55,56)(H,59,60)/t49?,50-/m0/s1
InChI key:
PZFZLRNAOHUQPH-GOOVXGPGSA-N
Assay: ≥98.0% (NT)
optical purity: __
mp: __
storage temp.: 2-8°C
SMILES string: OC(=O)[C@H]1CCNC1
InChI: 1S/C5H9NO2/c7-5(8)4-1-2-6-3-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
InChI key: JAEIBKXSIXOLOL-BYPYZUCNSA-N
Assay:
≥98.0% (NT)
optical purity:
__
mp:
__
storage temp.:
2-8°C
SMILES string:
OC(=O)[C@H]1CCNC1
InChI:
1S/C5H9NO2/c7-5(8)4-1-2-6-3-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1
InChI key:
JAEIBKXSIXOLOL-BYPYZUCNSA-N
Assay: ≥99.0% (HPLC)≥99.0%
optical purity: ee: ≥99.0% (HPLC)
mp: 113-117 °C
storage temp.: 2-8°C
SMILES string: OC([C@@H]1CCCN1)(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3cc(cc(c3)C(F)(F)F)C(F)(F)F
InChI: 1S/C21H15F12NO/c22-18(23,24)12-4-10(5-13(8-12)19(25,26)27)17(35,16-2-1-3-34-16)11-6-14(20(28,29)30)9-15(7-11)21(31,32)33/h4-9,16,34-35H,1-3H2/t16-/m0/s1
InChI key: ITXPGQOGEYWAKW-INIZCTEOSA-N
Assay:
≥99.0% (HPLC)≥99.0%
optical purity:
ee: ≥99.0% (HPLC)
mp:
113-117 °C
storage temp.:
2-8°C
SMILES string:
OC([C@@H]1CCCN1)(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3cc(cc(c3)C(F)(F)F)C(F)(F)F
InChI:
1S/C21H15F12NO/c22-18(23,24)12-4-10(5-13(8-12)19(25,26)27)17(35,16-2-1-3-34-16)11-6-14(20(28,29)30)9-15(7-11)21(31,32)33/h4-9,16,34-35H,1-3H2/t16-/m0/s1
InChI key:
ITXPGQOGEYWAKW-INIZCTEOSA-N