Diethyl (((6-chlorohexyl)amino)carbonyl)phosphonate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H23ClNO4P
Molecular Weight	299.731
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Diethyl (((6-chlorohexyl)amino)carbonyl)phosphonate

Structure Search

SMILES

CCOP(=O)(OCC)C(=O)NCCCCCCCl

InChI

InChIKey=SEZJXKVZYMQFCZ-UHFFFAOYSA-N

InChI=1S/C11H23ClNO4P/c1-3-16-18(15,17-4-2)11(14)13-10-8-6-5-7-9-12/h3-10H2,1-2H3,(H,13,14)

HIDE SMILES / InChI

Molecular Formula	C11H23ClNO4P
Molecular Weight	299.731
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 `Tue Apr 01 17:44:55 GMT 2025` Edited by `admin` on `Tue Apr 01 17:44:55 GMT 2025`
Record UNII	C83JB99YXU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Phosphonic acid, [[(6-chlorohexyl)amino]carbonyl]-, diethyl ester

Preferred Name

English

Diethyl (((6-chlorohexyl)amino)carbonyl)phosphonate

Systematic Name

English

Code System Code Type Description

PUBCHEM

44152222

Created by admin on Tue Apr 01 17:44:55 GMT 2025 , Edited by admin on Tue Apr 01 17:44:55 GMT 2025

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FDA UNII

C83JB99YXU

Created by admin on Tue Apr 01 17:44:55 GMT 2025 , Edited by admin on Tue Apr 01 17:44:55 GMT 2025

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ECHA (EC/EINECS)

278-785-6

Created by admin on Tue Apr 01 17:44:55 GMT 2025 , Edited by admin on Tue Apr 01 17:44:55 GMT 2025

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CAS

77889-87-3

Created by admin on Tue Apr 01 17:44:55 GMT 2025 , Edited by admin on Tue Apr 01 17:44:55 GMT 2025

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EPA CompTox

DTXSID90228498

Created by admin on Tue Apr 01 17:44:55 GMT 2025 , Edited by admin on Tue Apr 01 17:44:55 GMT 2025

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