670960

(S)-α,α-Bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol

≥99.0%

Manufacturer: Sigma Aldrich

CAS Number: 848821-76-1

Synonym(S): (S)-2-{Bis[3,5-bis(trifluoromethyl)phenyl]hydroxymethyl}pyrrolidine

Select a Size

Pack Size SKU Availability Price
1 G 670960-1-G In Stock ₹ 6,940.00

670960 - 1 G

₹ 6,940.00

In Stock

Quantity

1

Base Price: ₹ 6,940.00

GST (18%): ₹ 1,249.20

Total Price: ₹ 8,189.20

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

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SAFETY INFORMATION

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Show Difference

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Sigma Aldrich

670960

≥99.0%...


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

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≥95% (GC)

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mp:
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COC(=O)CCCCC=C

InChI:
1S/C8H14O2/c1-3-4-5-6-7-8(9)10-2/h3H,1,4-7H2,2H3

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RCMPWMPPJYBDKR-UHFFFAOYSA-N

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CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1N=[N+]=[N-]

InChI:
1S/C8H14N4O5/c1-3(14)10-5-7(16)6(15)4(2-13)17-8(5)11-12-9/h4-8,13,15-16H,2H2,1H3,(H,10,14)/t4-,5-,6-,7-,8-/m1/s1

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CCZCDCDASZJFGK-FMDGEEDCSA-N

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InChI:
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InChI key:
__