405965

2,2′-Methylenebis[(4S)-4-tert-butyl-2-oxazoline]

99%

Manufacturer: Sigma Aldrich

CAS Number: 132098-54-5

Synonym(S): (S,S)-2,2′-Methylenebis(4-tert-butyl-2-oxazoline)

Select a Size

Pack Size SKU Availability Price
500 MG 405965-500-MG In Stock ₹ 28,900.00

405965 - 500 MG

₹ 28,900.00

In Stock

Quantity

1

Base Price: ₹ 28,900.00

GST (18%): ₹ 5,202.00

Total Price: ₹ 34,102.00

Assay

99%

optical activity

[α]20/D −118°, c = 0.5 in chloroform

mp

51-53 °C (lit.)

SMILES string

CC(C)(C)[C@H]1COC(CC2=N[C@H](CO2)C(C)(C)C)=N1

InChI

1S/C15H26N2O2/c1-14(2,3)10-8-18-12(16-10)7-13-17-11(9-19-13)15(4,5)6/h10-11H,7-9H2,1-6H3/t10-,11-/m1/s1

InChI key

WCCCBUXURHZPQL-GHMZBOCLSA-N

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Description

  • Application: 2,2′-Methylenebis[(4S)-4-tert-butyl-2-oxazoline] (BOX ligand) can be used as a C2 symmetric ligand for enantioselective asymmetric catalysis. It easily forms bidentate coordination complexes due to the strong affinity of the oxazoline nitrogen for various metals.[1][2]

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Precautionary Statements

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

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

405965

99%...


Assay:
99%

optical activity:
[α]20/D −118°, c = 0.5 in chloroform

mp:
51-53 °C (lit.)

SMILES string:
CC(C)(C)[C@H]1COC(CC2=N[C@H](CO2)C(C)(C)C)=N1

InChI:
1S/C15H26N2O2/c1-14(2,3)10-8-18-12(16-10)7-13-17-11(9-19-13)15(4,5)6/h10-11H,7-9H2,1-6H3/t10-,11-/m1/s1

InChI key:
WCCCBUXURHZPQL-GHMZBOCLSA-N

Img

Sigma Aldrich

405973

98%...


Assay:
98%

optical activity:
[α]20/D −40.6°, c = 1 in ethanol

mp:
129-132 °C (lit.)

SMILES string:
C1OC(=N[C@H]1Cc2ccccc2)C3=N[C@H](CO3)Cc4ccccc4

InChI:
1S/C20H20N2O2/c1-3-7-15(8-4-1)11-17-13-23-19(21-17)20-22-18(14-24-20)12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2/t17-,18-/m0/s1

InChI key:
OIEQQWQZUYZCRJ-ROUUACIJSA-N

Img

Sigma Aldrich

405981

99%...


Assay:
99%

optical activity:
__

mp:
205-208 °C (lit.)

SMILES string:
C(C1=N[C@@H]([C@@H](O1)c2ccccc2)c3ccccc3)C4=N[C@@H]([C@@H](O4)c5ccccc5)c6ccccc6

InChI:
1S/C31H26N2O2/c1-5-13-22(14-6-1)28-30(24-17-9-3-10-18-24)34-26(32-28)21-27-33-29(23-15-7-2-8-16-23)31(35-27)25-19-11-4-12-20-25/h1-20,28-31H,21H2/t28-,29-,30+,31+/m1/s1

InChI key:
BVEHHQYXICTXGR-VKONIRKNSA-N

Img

Sigma Aldrich

406-05A

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Assay:
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optical activity:
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mp:
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SMILES string:
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InChI:
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InChI key:
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