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3-Allyl-benzoic acid, with the molecular formula C10H10O2, is a white to off-white crystalline powder. It has a molecular weight of 162.19 g/mol and is characterized by its strong, slightly floral odor. This chemical compound is utilized in various applications, including the production of fragrances, flavorings, and pharmaceuticals, as well as serving as an intermediate in organic chemical reactions.

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  • 1077-07-2 Structure
  • Basic information

    1. Product Name: 3-ALLYL-BENZOIC ACID
    2. Synonyms: 3-(2-PROPENYL)BENZOIC ACID;3-ALLYL-BENZOIC ACID
    3. CAS NO:1077-07-2
    4. Molecular Formula: C10H10O2
    5. Molecular Weight: 162.19
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1077-07-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 294.86°C at 760 mmHg
    3. Flash Point: 136.613°C
    4. Appearance: /
    5. Density: 1.108g/cm3
    6. Vapor Pressure: 0.001mmHg at 25°C
    7. Refractive Index: 1.557
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 3-ALLYL-BENZOIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-ALLYL-BENZOIC ACID(1077-07-2)
    12. EPA Substance Registry System: 3-ALLYL-BENZOIC ACID(1077-07-2)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1077-07-2(Hazardous Substances Data)

1077-07-2 Usage

Uses

Used in Fragrance Industry:
3-Allyl-benzoic acid is used as a fragrance ingredient for its strong, slightly floral scent, contributing to the formulation of perfumes and other scented products.
Used in Flavoring Industry:
In the flavoring industry, 3-allyl-benzoic acid is used as a flavoring agent, enhancing the taste profiles of various food and beverage products.
Used in Pharmaceutical Industry:
3-Allyl-benzoic acid is used as a key intermediate in the synthesis of pharmaceuticals, playing a crucial role in the development of new medications.
Used in Organic Chemical Reactions:
As an intermediate in organic chemical reactions, 3-allyl-benzoic acid is instrumental in the production of other chemical compounds, expanding its utility across different chemical applications.
It is important to handle 3-allyl-benzoic acid with care due to its potential to cause irritation to the skin, eyes, and respiratory system if proper safety measures are not observed.

Check Digit Verification of cas no

The CAS Registry Mumber 1077-07-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,0,7 and 7 respectively; the second part has 2 digits, 0 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 1077-07:
(6*1)+(5*0)+(4*7)+(3*7)+(2*0)+(1*7)=62
62 % 10 = 2
So 1077-07-2 is a valid CAS Registry Number.
InChI:InChI=1/C10H10O2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h2-3,5-7H,1,4H2,(H,11,12)

1077-07-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-prop-2-enylbenzoic acid

1.2 Other means of identification

Product number -
Other names 3-allylbenzoic acid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1077-07-2 SDS

1077-07-2Relevant articles and documents

Synthesis of C2-C3′N-linked macrocyclic taxoids. Novel docetaxel analogues with high tubulin activity

Querolle, Olivier,Dubois, Jo?lle,Thoret, Sylviane,Roussi, Fanny,Guéritte, Fran?oise,Guénard, Daniel

, p. 5937 - 5944 (2007/10/03)

Novel C2-C3′N-linked macrocyclic taxoids 4 bearing an aromatic ring at position C2 were synthesized. These compounds, tethered between N3′ and the C2-aromatic ring at the ortho, meta, or para position, were constructed by ring-closing metathesis. The para

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