N,N-Bis(2-chloroethyl)-1-butanamine hydrochloride

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H17Cl2N.ClH
Molecular Weight	234.594
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N-Bis(2-chloroethyl)-1-butanamine hydrochloride

Structure Search

SMILES

Cl.CCCCN(CCCl)CCCl

InChI

InChIKey=DNGSHNXJZOYVGI-UHFFFAOYSA-N

InChI=1S/C8H17Cl2N.ClH/c1-2-3-6-11(7-4-9)8-5-10;/h2-8H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula	C8H17Cl2N
Molecular Weight	198.133
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:40:16 GMT 2023` Edited by `admin` on `Sat Dec 16 12:40:16 GMT 2023`
Record UNII	77CT2QFB9A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N-Bis(2-chloroethyl)-1-butanamine hydrochloride

Systematic Name

English

1-Butanamine, N,N-bis(2-chloroethyl)-, hydrochloride

Systematic Name

English

NSC-72200

Code

English

Butylamine, N,N-bis(2-chloroethyl)-, hydrochloride

Systematic Name

English

1-Butanamine, N,N-bis(2-chloroethyl)-, hydrochloride (1:1)

Systematic Name

English

Code System Code Type Description

CAS

55112-89-5

Created by admin on Sat Dec 16 12:40:16 GMT 2023 , Edited by admin on Sat Dec 16 12:40:16 GMT 2023

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NSC

72200

Created by admin on Sat Dec 16 12:40:16 GMT 2023 , Edited by admin on Sat Dec 16 12:40:16 GMT 2023

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FDA UNII

77CT2QFB9A

Created by admin on Sat Dec 16 12:40:16 GMT 2023 , Edited by admin on Sat Dec 16 12:40:16 GMT 2023

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PUBCHEM

108674

Created by admin on Sat Dec 16 12:40:16 GMT 2023 , Edited by admin on Sat Dec 16 12:40:16 GMT 2023

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EPA CompTox

DTXSID40203634

Created by admin on Sat Dec 16 12:40:16 GMT 2023 , Edited by admin on Sat Dec 16 12:40:16 GMT 2023

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Related Record Type Details


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N,N-Bis(2-chloroethyl)-1-butanamine

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