713570

1,5-Cyclooctadiene{[dibenzyl((4R,5R)-5-methyl-2-phenyl-4,5-dihydro-4-oxazolyl)methyl]dicyclohexylphosphinite κN:κP}iridium(I) tetrakis(3,5-bis(trifluoromethyl)phenyl)borate

97%

Manufacturer: Sigma Aldrich

CAS Number: 880262-14-6

Synonym(S): Ubaphox, [((4R,5R)-Cy2-Ubaphox)Ir(COD)]BARF

Select a Size

Pack Size SKU Availability Price
1 G 713570-1-G In Stock ₹ 60,517.20
50 G 713570-50-G In Stock ₹ 6,56,531.70
100 G 713570-100-G In Stock ₹ 12,78,264.90

713570 - 1 G

₹ 60,517.20

In Stock

Quantity

1

Base Price: ₹ 60,517.20

GST (18%): ₹ 10,893.096

Total Price: ₹ 71,410.296

Quality Level

100

Assay

97%

form

powder

optical purity

ee: ≥99%

SMILES string

[Ir+].C1CC=CCCC=C1.C[C@H]2OC(=N[C@H]2C(Cc3ccccc3)(Cc4ccccc4)OP(C5CCCCC5)C6CCCCC6)c7ccccc7.FC(F)(F)c8cc(cc(c8)C(F)(F)F)[B-](c9cc(cc(c9)C(F)(F)F)C(F)(F)F)(c%10cc(cc(c%10)C(F)(F)F)C(F)(F)F)c%11cc(cc(c%11)C(F)(F)F)C(F)(F)F

InChI

1S/C37H46NO2P.C32H12BF24.C8H12.Ir/c1-29-35(38-36(39-29)32-21-11-4-12-22-32)37(27-30-17-7-2-8-18-30,28-31-19-9-3-10-20-31)40-41(33-23-13-5-14-24-33)34-25-15-6-16-26-34;34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-2-4-6-8-7-5-3-1;/h2-4,7-12,17-22,29,33-35H,5-6,13-16,23-28H2,1H3;1-12H;1-2,7-8H,3-6H2;/q;-1;;+1/b;;2-1-,8-7-;/t29-,35-;;;/m1.../s1

InChI key

BGPHLJWQZLLYML-XCHXSORBSA-N

Related Products

Img

Sigma Aldrich

713678

97%...

Img

Sigma Aldrich

691097

97%...

Img

Sigma Aldrich

693774

Umicore...

Img

Sigma Aldrich

692573

--

Img

Sigma Aldrich

692255

--

Img

Sigma Aldrich

692301

--

Img

Sigma Aldrich

692328

--

Description

  • Application: Catalyst for enantioselective hydrogenation of alkenes[1][2]
  • Packaging: Bottomless glass bottle. Contents are inside inserted fused cone.
  • Legal Information: sold in collaboration with Solvias AG

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

Compare Similar Items

Show Difference

Img

Sigma Aldrich

713570

97%...


Quality Level:
100

Assay:
97%

form:
powder

optical purity:
ee: ≥99%

SMILES string:
[Ir+].C1CC=CCCC=C1.C[C@H]2OC(=N[C@H]2C(Cc3ccccc3)(Cc4ccccc4)OP(C5CCCCC5)C6CCCCC6)c7ccccc7.FC(F)(F)c8cc(cc(c8)C(F)(F)F)[B-](c9cc(cc(c9)C(F)(F)F)C(F)(F)F)(c%10cc(cc(c%10)C(F)(F)F)C(F)(F)F)c%11cc(cc(c%11)C(F)(F)F)C(F)(F)F

InChI:
1S/C37H46NO2P.C32H12BF24.C8H12.Ir/c1-29-35(38-36(39-29)32-21-11-4-12-22-32)37(27-30-17-7-2-8-18-30,28-31-19-9-3-10-20-31)40-41(33-23-13-5-14-24-33)34-25-15-6-16-26-34;34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-2-4-6-8-7-5-3-1;/h2-4,7-12,17-22,29,33-35H,5-6,13-16,23-28H2,1H3;1-12H;1-2,7-8H,3-6H2;/q;-1;;+1/b;;2-1-,8-7-;/t29-,35-;;;/m1.../s1

InChI key:
BGPHLJWQZLLYML-XCHXSORBSA-N

Img

Sigma Aldrich

713589

11-15 % (w/w) in toluene, 97%...


Quality Level:
100

Assay:
≥96.5% (HPLC)97%

form:
liquid

optical purity:
__

SMILES string:
Cc1ccc(cc1)S(=O)(=O)N=[N+]=[N-]

InChI:
1S/C7H7N3O2S/c1-6-2-4-7(5-3-6)13(11,12)10-9-8/h2-5H,1H3

InChI key:
NDLIRBZKZSDGSO-UHFFFAOYSA-N

Img

Sigma Aldrich

71360

puriss. p.a., ≥99.0% (T)...


Quality Level:
200

Assay:
≥99.0% (T)

form:
crystals

optical purity:
__

SMILES string:
O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[O-]C([O-])=O

InChI:
1S/CH2O3.2Na.10H2O/c2-1(3)4;;;;;;;;;;;;/h(H2,2,3,4);;;10*1H2/q;2*+1;;;;;;;;;;/p-2

InChI key:
__

Img

Sigma Aldrich

71360

puriss. p.a., ≥99.0% (T)...


Quality Level:
200

Assay:
≥99.0% (T)

form:
crystals

optical purity:
__

SMILES string:
O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[O-]C([O-])=O

InChI:
1S/CH2O3.2Na.10H2O/c2-1(3)4;;;;;;;;;;;;/h(H2,2,3,4);;;10*1H2/q;2*+1;;;;;;;;;;/p-2

InChI key:
__