4-butyl-N,N-bis(2-chloroethyl)aniline

Modify Date: 2025-09-20 11:17:30

4-butyl-N,N-bis(2-chloroethyl)aniline Structure
4-butyl-N,N-bis(2-chloroethyl)aniline structure
Common Name 4-butyl-N,N-bis(2-chloroethyl)aniline
CAS Number 65406-08-8 Molecular Weight 274.22900
Density 1.101g/cm3 Boiling Point 372.8ºC at 760 mmHg
Molecular Formula C14H21Cl2N Melting Point N/A
MSDS N/A Flash Point 179.3ºC

 Names

Name 4-butyl-N,N-bis(2-chloroethyl)aniline

 Chemical & Physical Properties

Density 1.101g/cm3
Boiling Point 372.8ºC at 760 mmHg
Molecular Formula C14H21Cl2N
Molecular Weight 274.22900
Flash Point 179.3ºC
Exact Mass 273.10500
PSA 3.24000
LogP 4.31320
Index of Refraction 1.541
InChIKey BKAPJEGNJWLJEM-UHFFFAOYSA-N
SMILES CCCCc1ccc(N(CCCl)CCCl)cc1

 Synthetic Route

~%

4-butyl-N,N-bis(2-chloroethyl)aniline Structure

4-butyl-N,N-bis...

CAS#:65406-08-8

Literature: Everett et al. Journal of the Chemical Society, 1953 , p. 2386,2387

 4-butyl-N,N-bis(2-chloroethyl)anilineBioassay

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Name: Compound was evaluated for mutagenicity after threshold range
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL728312
Name: Stability of the compound in acetone assessed as hydrolysis at 66 degC after 30 mins
Source: ChEMBL
Target: N/A
External Id: CHEMBL3254298
Name: Compound was evaluated for Carcinogenicity based on concentration necessary to produc...
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL723857
Name: Compound was evaluated for low level mutagenicity
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL730746
Name: Antitumor activity against mouse B16 cells allografted in ip dosed BDF mouse assessed...
Source: ChEMBL
Target: B16
External Id: CHEMBL3255120
Name: Antitumor activity against mouse B16 cells allografted in BDF mouse assessed as incre...
Source: ChEMBL
Target: B16
External Id: CHEMBL3255122
Name: Compound was evaluated for Carcinogenicity to produce 0.5 tumors per mouse (B.5)
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL728309
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