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3-(dimethylamino)propanenitrile hydrochloride (1:1) is a chemical compound with the molecular formula C5H10N2·HCl. It is a white crystalline solid that is soluble in water and ethanol. 3-(dimethylamino)propanenitrile hydrochloride (1:1) is primarily used as a pharmaceutical intermediate, specifically in the synthesis of various drugs, including antidepressants and antipsychotics. It is also known as 3-(dimethylamino)propionitrile hydrochloride and is commonly referred to as DMAP hydrochloride. The compound is characterized by its dimethylamino group, which provides it with unique chemical properties and reactivity. It is important to handle this substance with care due to its potential toxicity and to follow proper safety protocols during its use and storage.

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  • 18076-02-3 Structure
  • Basic information

    1. Product Name: 3-(dimethylamino)propanenitrile hydrochloride (1:1)
    2. Synonyms:
    3. CAS NO:18076-02-3
    4. Molecular Formula: C5H10N2*ClH
    5. Molecular Weight: 134.6072
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 18076-02-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 173.9°C at 760 mmHg
    3. Flash Point: 62.8°C
    4. Appearance: N/A
    5. Density: N/A
    6. Vapor Pressure: 1.24mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 3-(dimethylamino)propanenitrile hydrochloride (1:1)(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-(dimethylamino)propanenitrile hydrochloride (1:1)(18076-02-3)
    12. EPA Substance Registry System: 3-(dimethylamino)propanenitrile hydrochloride (1:1)(18076-02-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 18076-02-3(Hazardous Substances Data)

18076-02-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 18076-02-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,8,0,7 and 6 respectively; the second part has 2 digits, 0 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 18076-02:
(7*1)+(6*8)+(5*0)+(4*7)+(3*6)+(2*0)+(1*2)=103
103 % 10 = 3
So 18076-02-3 is a valid CAS Registry Number.

18076-02-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name hydrochloride of 3-dimethylaminopropionitrile

1.2 Other means of identification

Product number -
Other names N,N-Dimethyl-β-alanin-nitril, Hydrochlorid

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:18076-02-3 SDS

18076-02-3Downstream Products

18076-02-3Relevant articles and documents

REACTION OF 2,4-DISUBSTITUTED CHLOROBENZENES WITH 3-ALKYLAMINO- AND 3-DIALKYLAMINOPROPIONITRILES

Plakidin, Val. L.,Vostrova, V. N.

, p. 295 - 303 (2007/10/02)

The reaction of 2,4-disubstituted chlorobenzenes with 3-dialkylaminopropionitriles at 65-170 deg C leads to the formation of 2,4-disubstituted N,N-dialkylanilines, and the reaction with 3-alkylaminopropionitriles at 20-130 deg C leads to the formation of 2,4-disubstituted N-alkyl-N-β-cyanoethylanilines.In addition, in the latter case at high temperature (130 deg C) the cyanoethyl group is removed from the substituted N-alkyl-N-β-cyanoethylaniline with the formation of the 2,4-disubstituted N-alkylaniline.

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