Diisobutyl Phthalate-d4, Diisodecyl Phthalate-d4, and Diisononyl Phthalate-d4 Mixture (0.1 mg/mL in Acetonitrile)
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- structure.search.product.name Diisobutyl Phthalate-d4, Diisodecyl Phthalate-d4, and Diisononyl Phthalate-d4 Mixture (0.1 mg/mL in Acetonitrile)
- Product Code: TRC-KIT7922-1X1ML
- Brand: TRC
Product Overview
Product Code
TRC-KIT7922-1X1ML
CAS Number
3 AnalytesProduct Format
Mixture
Matrix
Acetonitrile
Product Categories
Product Type
Stable Isotope LabelledUnlabelled CAS Number
3 AnalytesDocumentation
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Product Information
Chemical Data
Analyte Name
Measured Value
CAS Number
Molecular Structure
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Phthalic Acid Di-isononyl Ester (3,4,5,6)-D4
0.1 mg/mL
Phthalic acid, bis-iso-butyl ester D4
0.1 mg/mL
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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Diisodecyl phthalate-d4
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
C28 2H4 H42 O4
Molecular Weight
450.69
Accurate Mass
450.3647
SMILES
[2H]c1c([2H])c([2H])c(C(=O)OCCCCCCCC(C)C)c(C(=O)OCCCCCCCC(C)C)c1[2H]
InChI
InChI=1S/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3/i13D,14D,19D,20D
IUPAC
bis(8-methylnonyl) 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Phthalic Acid Di-isononyl Ester (3,4,5,6)-D4
CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
C26 2H4 H38 O4
Molecular Weight
422.63
Accurate Mass
422.3334
SMILES
[2H]c1c([2H])c([2H])c(C(=O)OCCCCCCC(C)C)c(C(=O)OCCCCCCC(C)C)c1[2H]
InChI
InChI=1S/C26H42O4/c1-21(2)15-9-5-7-13-19-29-25(27)23-17-11-12-18-24(23)26(28)30-20-14-8-6-10-16-22(3)4/h11-12,17-18,21-22H,5-10,13-16,19-20H2,1-4H3/i11D,12D,17D,18D
IUPAC
bis(7-methyloctyl) 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Phthalic acid, bis-iso-butyl ester D4
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
Molecular Formula
C16 2H4 H18 O4
Molecular Weight
282.37
Accurate Mass
282.1769
SMILES
[2H]c1c([2H])c([2H])c(C(=O)OCC(C)C)c(C(=O)OCC(C)C)c1[2H]
InChI
InChI=1S/C16H22O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3/i5D,6D,7D,8D
IUPAC
bis(2-methylpropyl) 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Mixture
Matrix
Acetonitrile
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