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1-amino-7-[bis(2-chloroethyl)amino]-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid is a complex organic compound with the molecular formula C16H19Cl2N2O2. It is a derivative of naphthalene, a bicyclic aromatic hydrocarbon, with a tetrahydro structure, meaning one of its rings has been reduced to a single bond. The compound features an amino group at the 1-position, a bis(2-chloroethyl)amino group at the 7-position, and a carboxylic acid group at the 1-position. The presence of two chlorine atoms in the molecule contributes to its potential reactivity and biological activity. This chemical is known for its cytotoxic properties and is used in the synthesis of certain anticancer drugs, such as mechlorethamine, which is a nitrogen mustard alkylating agent. The structure and functional groups of 1-amino-7-[bis(2-chloroethyl)amino]-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid make it a significant player in medicinal chemistry, particularly in the development of chemotherapeutic agents.

5591-50-4

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5591-50-4 Usage

Chemical structure

A complex chemical compound consisting of a naphthalene ring with a carboxylic acid group and an amino group, as well as two bis(2-chloroethyl)amino groups attached to the naphthalene ring.

Potential carcinogenicity

Likely to be a potential carcinogen due to its structural similarity to nitrogen mustard compounds, which are known for their toxic and mutagenic properties.

Relation to nitrogen mustard compounds

Structurally related to nitrogen mustard compounds, which are known for their toxic and mutagenic properties.

Applications in medicine

May have applications in the field of medicine, particularly in the development of anti-cancer drugs and treatments.

Hazardous properties

Due to its complex structure and potential hazardous properties, 1-amino-7-[bis(2-chloroethyl)amino]-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid will require careful handling and further research to fully understand its potential applications and risks.

Further research needed

Requires additional research to fully understand its potential applications, risks, and to determine safe handling procedures.

Check Digit Verification of cas no

The CAS Registry Mumber 5591-50-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,5,9 and 1 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 5591-50:
(6*5)+(5*5)+(4*9)+(3*1)+(2*5)+(1*0)=104
104 % 10 = 4
So 5591-50-4 is a valid CAS Registry Number.

5591-50-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-amino-7-[bis(2-chloroethyl)amino]-3,4-dihydro-2H-naphthalene-1-carboxylic acid

1.2 Other means of identification

Product number -
Other names 1-amino-7-[bis(2-chloroethyl)amino]-1,2,3,4-tetrahydronaphthalene-1-carboxylic 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:5591-50-4 SDS

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