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42978-43-8

Basic Information
CAS No.: 42978-43-8
Name: 6-acetoxymethylbenzo(a)pyrene
Article Data: 1
Molecular Structure:
Molecular Structure of 42978-43-8 (6-acetoxymethylbenzo(a)pyrene)
Formula: C23H16O2
Molecular Weight: 324.379
Synonyms: 6-Acetoxymethylbenzpyren;
Density: 1.303g/cm3
Boiling Point: 527.8°C at 760 mmHg
Flash Point: 211.1°C
Safety: Questionable carcinogen with experimental neoplastigenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
PSA: 26.30000
LogP: 5.80030
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  • 6-ACETYLOXYMETHYLBENZO(a)PYRENE

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    42978-43-8

    6-ACETYLOXYMETHYLBENZO(a)PYRENE

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    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

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  • 6-ACETYLOXYMETHYLBENZO(a)PYRENE

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    42978-43-8

    6-ACETYLOXYMETHYLBENZO(a)PYRENE

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    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

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  • benzo[a]pyren-6-ylmethyl acetate

  • Casno:

    42978-43-8

    benzo[a]pyren-6-ylmethyl acetate

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    We are committed to providing our customers with the best products and services at the most competitive prices.Appearance:Powder Storage:Room temperature with sealed well Package:according to the clients requirement Application:Use as primary and sec

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Chemistry

IUPAC Name: benzo[a]pyren-6-ylmethyl acetate 
Empirical Formula: C23H16O2
Molecular Weight: 324.3719g/mol
Structure of 6-Acetoxymethylbenzo(a)pyrene (CAS NO.42978-43-8):

Index of Refraction: 1.798
Molar Refractivity: 106.26 cm3
Molar Volume: 248.9 cm3
Polarizability: 42.12×10-24cm3
Surface Tension: 60.6 dyne/cm
Density: 1.303 g/cm3
Flash Point: 211.1 °C
Enthalpy of Vaporization: 80.25 kJ/mol
Boiling Point: 527.8 °C at 760 mmHg
Vapour Pressure: 3.14E-11 mmHg at 25°C 
Classification Code: Mutation data, Tumor data 
Canonical SMILES: CC(=O)OCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51
InChI: InChI=1S/C23H16O2/c1-14(24)25-13-21-18-8-3-2-7-17(18)19-11-9-15-5-4-6-16-10-12-20(21)23(19)22(15)16/h2-12H,13H2,1H3
InChIKey: AIXMKWLMVGVTGG-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

mmo-sat 1 nmol/plate

    PAACA3    Proceedings of the American Association for Cancer Research. 24 (1983),93.
2.    

dnd-rat:lym 500 mg/L

    CBINA8    Chemico-Biological Interactions. 25 (1979),35.
3.    

dnd-mam:lym 500 mg/L

    CBINA8    Chemico-Biological Interactions. 25 (1979),35.

Safety Profile

Questionable carcinogen with experimental neoplastigenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.

Specification

  6-Acetoxymethylbenzo(a)pyrene , its cas register number is 42978-43-8. It also can be called 6-Acetyloxymethylbenzo(a)pyrene ; BRN 2476599 ; Benzo(a)pyrene-6-methanol, acetate (ester) ; CCRIS 2789 . 6-Acetoxymethylbenzo(a)pyrene (CAS NO.42978-43-8) is flammable, and the storage environment should be ventilate, low-temperature and dry.