Bis(6-methylheptyl) phthalate

Basic Information

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CAS Number

27554-26-3

Molecular Formula

C24H38O4

Molecular Weight

390.56 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

-4°C

Boiling Point

435.74°C (rough estimate)

Flash Point

>230 °F

Refractive Index

1.486

Vapor Pressure

1 mm Hg ( 200 °C)

SMILES

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CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C

InChI

InChI=1S/C24H38O4/c1-19(2)13-7-5-11-17-27-23(25)21-15-9-10-16-22(21)24(26)28-18-12-6-8-14-20(3)4/h9-10,15-16,19-20H,5-8,11-14,17-18H2,1-4H3

InChIKey

IJFPVINAQGWBRJ-UHFFFAOYSA-N

LogP

6.433000000000007

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

390

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AKOS015916164
EINECS 248-523-5
Diisooctyl 1,2-benzenedicarboxylate
AS-17769
CAS-27554-26-3
1,2Benzenedicarboxylic acid, diisooctyl ester
AI3-27697-X (USDA)
Hexaplas M/O (Salt/Mix)
1,2-Benzenedicarboxylic acid, 1,1'-(2,2-dimethyl-1,3-propanediyl) 2,2'-diisooctyl ester
131-20-4
NS00015578
DTXSID50873226
D70235
Di-iso-octyl phthalate
DIISOOCTYL PHTHALATE [HSDB]
bis(6-methylheptyl) benzene-1,2-dicarboxylate
JAYFLEX DIOP
Phthalic acid, bis-6-methylheptyl ester
Tox21_200466
1,2-Benzenedicarboxylic acid, bis(6-methylheptyl) ester
Diop
Phthalic acid, diisooctyl ester
Diisooctyl phthalate
DSSTox_CID_7933
Corflex 880
27554-26-3
SCHEMBL109014
DSSTox_GSID_27933
NCGC00258020-01
CS-0154229
BIDD:ER0438

MDL Number

MFCD00036241

FAQ

What regulatory guidelines apply to Bis(6-methylheptyl) phthalate (CAS: 27554-26-3)?

Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) falls under the GHS classification system and is subject to various regulations such as REACH in the EU, which requires registration, evaluation, and authorization of chemical substances. It is also regulated by FDA and EPA in the USA for safety and environmental concerns. Compliance with these guidelines ensures safe handling and disposal.

Are there alternatives to Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) in synthesis?

Yes, there are alternatives to Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) in synthesis, such as other phthalates or plasticizers like adipate esters and trimellitates. These alternatives offer similar properties but may have different advantages and disadvantages depending on the specific application, such as lower cost, better biodegradability, or improved stability.

What is the market or research trend for Bis(6-methylheptyl) phthalate (CAS: 27554-26-3)?

The market for Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) is experiencing shifts due to increasing emphasis on sustainable and eco-friendly materials. Research trends are moving towards developing alternatives with better environmental performance. Market trends show a need for safer and more sustainable plasticizers, driving innovation in the industry.

How should waste containing Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) be handled?

Waste containing Bis(6-methylheptyl) phthalate (CAS: 27554-26-3) should be managed according to hazardous waste regulations. It should be collected in appropriate containers, labeled, and stored away from incompatible materials. Professional waste disposal services should be used for incineration or other safe disposal methods to ensure environmental protection and compliance with regulatory requirements.