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Home › Product Catalog › 2,6-dibromo-4-cyanophenyl octanoate

2,6-dibromo-4-cyanophenyl octanoate

CAS 1689-99-2C15H17Br2NO2MW 403.11

2,6-dibromo-4-cyanophenyl octanoate (CAS No. 1689-99-2) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Organic Chemicals. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Specifications

CAS Number1689-99-2
Molecular FormulaC15H17Br2NO2
Molecular Weight403.11
Melting Point45-46 °C
LogPlog Kow = 5.4
Purity按批次COA提供(不公开发布)
Packaging按订单/批次确认(不公开发布)
ApplicationsOrganic Chemicals
CategoryOrganic Chemicals

Where it is used

Organic Chemicals

Packaging & Supply

Packaging按订单/批次确认(不公开发布)
Purity按批次COA提供(不公开发布)
StorageSealed, cool and dry place
Lead TimeIn stock / per order

Documents & Support

COA provided with every batch; MSDS and technical documents available on request. Email us with product name and CAS number for a quote within one business day.

Frequently Asked Questions

What is the CAS number of 2,6-dibromo-4-cyanophenyl octanoate?

The CAS number of 2,6-dibromo-4-cyanophenyl octanoate is 1689-99-2.

What purity and packaging are available?

Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.

What are the applications of 2,6-dibromo-4-cyanophenyl octanoate?

Main applications include Organic Chemicals.

How do I buy 2,6-dibromo-4-cyanophenyl octanoate or get a quote?

Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..

PubChem Public Data

Description

2,6-dibromo-4-cyanophenyl octanoate · CAS 1689-99-2 · C15H17Br2NO2. UNII 9HL5XAW9SK. Melting Point: 45-46 °C; Flash Point: 102 °F, 39 °C (TCC); Solubility: In water, 0.08 mg/L at 25 °C.

Identification

CAS Registry Number1689-99-2
PubChem CID15533
Molecular formulaC15H17Br2NO2
IUPAC name(2,6-dibromo-4-cyanophenyl) octanoate
UNII (FDA)9HL5XAW9SK

Computed Descriptors

Molecular Weight403.11
XLogP35.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass402.96055
Monoisotopic Mass400.96260
Topological Polar Surface Area50.1
Heavy Atom Count20
Formal Charge0

Physical & Chemical Properties

Melting Point45-46 °C
Flash Point102 °F, 39 °C (TCC)
SolubilityIn water, 0.08 mg/L at 25 °C
Vapor Pressure0.0000048 [mmHg]
Vapor Pressure0.64 mPa (4.8X10-6 mm Hg) at 25 °C
LogPlog Kow = 5.4
LogP6.1

Physical description & handling notes

  • Bromoxynil octanoate, [solid] appears as a solid. Used as a selective contact herbicide.
  • Solid; [Merck Index] Nearly white crystalline solid; [MSDSonline]
  • Cream, waxy solid
  • Clear, amber waxy solid
  • Characteristic odor
  • In chloroform 800, xylene, dimethylformamide 700, ethyl acetate 620, cyclohexanone 550, carbon tetrachloride 500, n-propanol 120, acetone, ethanol 100 (all in g/L 20-25 °C)

GHS Hazard Classification

Reported hazard statementsH302, H317, H331, H400, H410, H301, H312 (27.1%), H361 (79.3%)

H302: Harmful if swallowed [Warning Acute toxicity, oral]

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

Documented Uses

  • Used as herbicide for cereals, field corn, popcorn, other crops, and alfalfa in Conservation Reserve Program; [HSDB]
  • Herbicide ... for barley, field corn, flax, garlic, mint, oats, onions, popcorn, rye, seedling alfalfa, sorghum, triticale, wheat, forage grasses, grass for sod and seed protection and alfalfa in Conservation Reserve Program.
  • Bromoxynil octanoate is made from bromoxynil by reacting it with octanoic acid or with octanoyl chloride in the presence of pyridine.
  • Octanoic acid, 2,6-dibromo-4-cyanophenyl ester: ACTIVE
  • A study with the octanoate ester in rats showed that after an oral dose, uptake was moderate. Peak plasma levels were attained 7 to 10 hours after dosing. Most of the dose was eliminated within 7 days, primarily in the urine.
  • Dermal uptake studies in rats show an absorption in 24 hr of 11 to 18 % for the octanoate ester depending on concentration...

Synonyms

Bromoxynil octanoate; 1689-99-2; 2,6-DIBROMO-4-CYANOPHENYL OCTANOATE; Brominal W; Octanoic acid, 2,6-dibromo-4-cyanophenyl ester; DTXSID7023932; NPH 1320; Bromoxynil octanoic acid ester; 9HL5XAW9SK; 4-Cyano-2,6-dibromophenyl octanoate; DTXCID803932; Octanoic acid ester of 3,5-dibromo-4-hydroxybenzonitrile; RefChem:121659; 3,5-Dibromo-4-octanoyloxybenzonitrile; 216-885-3; M&B 10731

Frequently Asked Questions

What are the CAS number and molecular formula of 2,6-dibromo-4-cyanophenyl octanoate?

CAS 1689-99-2; molecular formula C15H17Br2NO2; molecular weight — g/mol.

What other names is 2,6-dibromo-4-cyanophenyl octanoate known by?

Bromoxynil octanoate, 1689-99-2, 2,6-DIBROMO-4-CYANOPHENYL OCTANOATE, Brominal W, Octanoic acid, 2,6-dibromo-4-cyanophenyl ester, DTXSID7023932.

Is 2,6-dibromo-4-cyanophenyl octanoate classified as hazardous?

Hazard statements reported: H302, H317, H331, H400, H410.

What are the key physical properties of 2,6-dibromo-4-cyanophenyl octanoate?

Melting Point: 45-46 °C; Flash Point: 102 °F, 39 °C (TCC); Solubility: In water, 0.08 mg/L at 25 °C; Vapor Pressure: 0.0000048 [mmHg].

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.

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