574589

3,5-Di-tert-butylbenzaldehyde

97%

Manufacturer: Sigma Aldrich

CAS Number: 17610-00-3

Synonym(S): 3,5-Di-tert-butyl-benzaldehyde

Select a Size

Pack Size SKU Availability Price
1 G 574589-1-G In Stock ₹ 8,660.00
5 G 574589-5-G In Stock ₹ 30,006.90

574589 - 1 G

₹ 8,660.00

In Stock

Quantity

1

Base Price: ₹ 8,660.00

GST (18%): ₹ 1,558.80

Total Price: ₹ 10,218.80

Quality Level

200

Assay

97%

form

solid

mp

85-89 °C (lit.)

SMILES string

CC(C)(C)c1cc(C=O)cc(c1)C(C)(C)C

InChI

1S/C15H22O/c1-14(2,3)12-7-11(10-16)8-13(9-12)15(4,5)6/h7-10H,1-6H3

InChI key

BRUITYMDHWNCIG-UHFFFAOYSA-N

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Description

  • Application: 3,5-Di-tert-butylbenzaldehyde may be used in the synthesis of the following:5-p-pyridyl-15-(3,5-di-tert-butylphenyl)porphyrin via condensation reaction with 4-pyridinecarboxaldehyde and 2,2′-dipyrrylmethane[1]3,5-di-tert-butylphenyl-dipyrromethane via reaction with pyrrole in the presence of trifluoroacetic acid[2]3,5-di-tert-butyl-2-nitrobenzaldehyde via nitration reaction[3]

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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574589

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Quality Level:
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Assay:
97%

form:
solid

mp:
85-89 °C (lit.)

SMILES string:
CC(C)(C)c1cc(C=O)cc(c1)C(C)(C)C

InChI:
1S/C15H22O/c1-14(2,3)12-7-11(10-16)8-13(9-12)15(4,5)6/h7-10H,1-6H3

InChI key:
BRUITYMDHWNCIG-UHFFFAOYSA-N

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Oc1cc(Br)c(O)cc1Br

InChI:
1S/C6H4Br2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,9-10H

InChI key:
VALXCIRMSIFPFN-UHFFFAOYSA-N

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99.8% trace metals basis (excludes Mg)

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SMILES string:
[Ca++].[Ca++].[Ca++].[Ca++].O[Ca+].[O-]P([O-])([O-])=O.[O-]P([O-])([O-])=O.[O-]P([O-])([O-])=O

InChI:
1S/5Ca.3H3O4P.H2O/c;;;;;3*1-5(2,3)4;/h;;;;;3*(H3,1,2,3,4);1H2/q5*+2;;;;/p-10

InChI key:
XYJRXVWERLGGKC-UHFFFAOYSA-D

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InChI:
__

InChI key:
__