CAS 137-89-3 Bis(2-ethylhexyl) isophthalate - Materials / Alfa Chemistry

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Bis(2-ethylhexyl) isophthalate

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Catalog Number

ACM137893-1

Product Name

Bis(2-ethylhexyl) isophthalate

Structure

CAS

137-89-3

Category

Plastic Additives

Synonyms

1,3-Benzenedicarboxylic acid 1,3-bis(2-ethylhexyl) ester, DOIP, Di-2-ethylhexyl isophthalate, Isophthalic acid bis(2-ethylhexyl ester)

Description

Bis(2-ethylhexyl) isophthalate is a clear light yellow viscous liquid. (NTP, 1992)

IUPAC Name

bis(2-ethylhexyl) benzene-1,3-dicarboxylate

Molecular Weight

390.56

Molecular Formula

C24H38O4

Canonical SMILES

CCCCC(CC)COC(=O)C1=CC(=CC=C1)C(=O)OCC(CC)CCCC

InChI

InChI=1S/C24H38O4/c1-5-9-12-19(7-3)17-27-23(25)21-14-11-15-22(16-21)24(26)28-18-20(8-4)13-10-6-2/h11,14-16,19-20H,5-10,12-13,17-18H2,1-4H3

InChI Key

WXZOXVVKILCOPG-UHFFFAOYSA-N

Flash Point

greater than 200 °F (NTP, 1992)

Purity

98%

Solubility

less than 1 mg/mL at 61° F (NTP, 1992)

Complexity

396

Covalently-Bonded Unit Count

EC Number

205-308-0

Exact Mass

390.27701g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

390.27701g/mol

NSC Number

78995;6358

Rotatable Bond Count

UNII

0WDI822P2U

XLogP3

7.4

MSDS

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COA

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Spec Sheet

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137-89-3
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