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53306-53-9

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Basic Information
CAS No.: 53306-53-9
Name: DI(3-METHYLHEXYL)PHTHALATE
Molecular Structure:
Molecular Structure of 53306-53-9 (DI(3-METHYLHEXYL)PHTHALATE)
Formula: C22H34O4
Molecular Weight: 362.56
Density: 0.995g/cm3
Boiling Point: 363.6°Cat760mmHg
Flash Point: 192.4°C
Safety: Mildly toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 0.00000
LogP: 0.00000
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  • DI(3-METHYLHEXYL)PHTHALATE

  • Casno:

    53306-53-9

    DI(3-METHYLHEXYL)PHTHALATE

    Min.Order: 1 Gram

    FOB Price:  USD $ 0.0-0.0

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemicals. W

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, s

  •  Shandong Mopai Biotechnology Co., LTD

    China (Mainland)  |  Contact Details

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    Address:shandong

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  • DI(3-METHYLHEXYL)PHTHALATE

  • Casno:

    53306-53-9

    DI(3-METHYLHEXYL)PHTHALATE

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    hight degree of purity Application:Fine chemical intermediates, used as the main raw material for he synthesis of various pesticides, medicines, surfactants, polymer monomers, Ond Ontifungal agents

    Antimex Chemical Limied, was founded in 2001, we are specializing in manufacturing & researching of Active pharmaceutical Ingredients,Veterinary pharm APIs,cosmetic ingredients,and

  •  Antimex Chemical Limied

    China (Mainland)  |  Contact Details

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    Address:Room1027,No.Jinyu Road,Pudong

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Chemistry

Molecule structure of Di(3-methylhexyl)phthalate (CAS NO.53306-53-9):

IUPAC Name: Bis(3-methylhexyl) benzene-1,2-dicarboxylate 
Molecular Weight: 362.50296 g/mol
Molecular Formula: C22H34O4 
Density: 0.995 g/cm3 
Boiling Point: 363.6 °C at 760 mmHg 
Flash Point: 192.4 °C
Index of Refraction: 1.49
Molar Refractivity: 105.31 cm3
Molar Volume: 364 cm3
Polarizability: 41.74×10-24 cm3
Surface Tension: 35.5 dyne/cm 
Enthalpy of Vaporization: 60.96 kJ/mol
Vapour Pressure: 1.79E-05 mmHg at 25 °C
XLogP3: 7.8
H-Bond Acceptor: 4
Rotatable Bond Count: 14
Exact Mass: 362.24571
MonoIsotopic Mass: 362.24571
Topological Polar Surface Area: 52.6
Heavy Atom Count: 26
Complexity: 369
Canonical SMILES: CCCC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)CCC
InChI: InChI=1S/C22H34O4/c1-5-9-17(3)13-15-25-21(23)19-11-7-8-12-20(19)22(24)26-16-14-18(4)10-6-2/h7-8,11-12,17-18H,5-6,9-10,13-16H2,1-4H3
InChIKey of Di(3-methylhexyl)phthalate (CAS NO.53306-53-9): PLVCZTJOXIYQSA-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-rat LD50:35,500 mg/kg

     GTPZAB    Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 24 (3)(1980),25.
2.    

orl-mus LD50:35,500 mg/kg

     GTPZAB    Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 24 (3)(1980),25.
3.    

orl-gpg LD50:35,500 mg/kg

     GTPZAB    Gigiena Truda i Professionalnye Zabolevaniia. Labor Hygiene and Occupational Diseases. 24 (3)(1980),25.

Safety Profile

Mildly toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes.

Specification

 Di(3-methylhexyl)phthalate (CAS NO.53306-53-9) is also named as Phthalic acid, bis(3-methylhexyl) ester .