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Merck

8.01809

Benzyl chloride

for synthesis

同義詞:

Benzyl chloride

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關於此項目

經驗公式(希爾表示法):
C7H7Cl
CAS 編號:
分子量::
126.58
MDL號碼:
分類程式碼代碼:
12352101
酶委員會索引編號:
202-853-6
NACRES:
NA.22

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蒸汽壓力

1.2 hPa ( 20 °C)

品質等級

化驗

≥99.0% (GC)

形狀

liquid

自燃溫度

585 °C

效力

440 mg/kg LD50, oral (Rat)

expl. lim.

1.1-14 % (v/v)

bp

179.3 °C/1013 hPa

mp

-39 °C

轉變溫度

flash point 67 °C

溶解度

460 mg/L

密度

1.10 g/cm3 at 20 °C

儲存溫度

2-30°C

SMILES 字串

ClCc1ccccc1

InChI

1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2

InChI 密鑰

KCXMKQUNVWSEMD-UHFFFAOYSA-N

比較類似項目

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1 of 4

本產品
8.018041.017161.02083
assay

≥99.0% (GC)

assay

≥99.0% (GC)

assay

99.995%

assay

-

solubility

460 mg/L

solubility

-

solubility

-

solubility

740 g/L

Quality Level

200

Quality Level

200

Quality Level

100

Quality Level

100

storage temp.

2-30°C

storage temp.

2-30°C

storage temp.

2-30°C

storage temp.

2-30°C

density

1.10 g/cm3 at 20 °C

density

1.21 g/cm3 at 20 °C

density

3.9 g/cm3 at 20 °C

density

2.15 g/cm3 at 20 °C

form

liquid

form

liquid

form

solid

form

solid

應用

  • Research on the Oxidative Chlorination of Toluene to Benzyl Chloride by Chloride Ion: This study explores the preparation of benzyl chloride through oxidative chlorination under LED blue light, achieving a 40% yield (Y Bai, X Cheng, A Zheng, H Shen, 2019).
  • Tertiary amines nucleophilicity in quaternization reaction with benzyl chloride: Investigates the kinetics of the quaternization reaction of tertiary amines with benzyl chloride, providing insights into reaction mechanisms and conditions (KS Yutilova, SG Bakhtin, OM Shved, et al., 2015).
  • Synthesis and inhibition profiles of N-benzyl-and N-allyl aniline derivatives against carbonic anhydrase and acetylcholinesterase–A molecular docking study: Focuses on the synthesis of N-benzyl derivatives and their biological activity, utilizing benzyl chloride as a key intermediate in the synthesis process (I Mahmudov, Y Demir, Y Sert, Y Abdullayev, et al., 2022).

分析報告

Assay (GC, area%): ≥ 99.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.099 - 1.100
Identity (IR): passes test

訊號詞

Danger

危險分類

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Carc. 1B - Eye Dam. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT RE 2 Oral - STOT SE 3

標靶器官

Respiratory system

儲存類別代碼

6.1A - Combustible, acute toxic Cat. 1 and 2 / very toxic hazardous materials

水污染物質分類(WGK)

WGK 3

閃點(°F)

152.6 °F

閃點(°C)

67 °C


分析證明 (COA)

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Questions

1–3 of 3 Questions  
  1. Does the Material contain stabiliser?

    1 answer
    1. This product does not contain a stabilizer.

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  2. How can I determine the shelf life / expiration / retest date of this product?

    1 answer
    1. If this product has an expiration or retest date, it will be shown on the Certificate of Analysis (COA, CofA). If there is no retest or expiration date listed on the product's COA, we do not have suitable stability data to determine a shelf life. For these products, the only date on the COA will be the release date; a retest, expiration, or use-by-date will not be displayed.
      For all products, we recommend handling per defined conditions as printed in our product literature and website product descriptions. We recommend that products should be routinely inspected by customers to ensure they perform as expected.
      For products without retest or expiration dates, our standard warranty of 1 year from the date of shipment is applicable.
      For more information, please refer to the Product Dating Information document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/418/501/product-dating-information-06-25-mk.pdf

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  3. How is shipping temperature determined? And how is it related to the product storage temperature?

    1 answer
    1. Products may be shipped at a different temperature than the recommended long-term storage temperature. If the product quality is sensitive to short-term exposure to conditions other than the recommended long-term storage, it will be shipped on wet or dry-ice. If the product quality is NOT affected by short-term exposure to conditions other than the recommended long-term storage, it will be shipped at ambient temperature. As shipping routes are configured for minimum transit times, shipping at ambient temperature helps control shipping costs for our customers. For more information, please refer to the Storage and Transport Conditions document: https://www.sigmaaldrich.com/deepweb/assets/sigmaaldrich/marketing/global/documents/316/622/storage-transport-conditions-mk.pdf

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