4,4-DIACETYLHEPTANEDINITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14N2O2
Molecular Weight	206.2411
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4-DIACETYLHEPTANEDINITRILE

Structure Search

SMILES

CC(=O)C(CCC#N)(CCC#N)C(C)=O

InChI

InChIKey=QDIYYSFUYAGTHN-UHFFFAOYSA-N

InChI=1S/C11H14N2O2/c1-9(14)11(10(2)15,5-3-7-12)6-4-8-13/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C11H14N2O2
Molecular Weight	206.2411
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 12:45:10 GMT 2023` Edited by `admin` on `Sat Dec 16 12:45:10 GMT 2023`
Record UNII	X1LM63FW5U
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4,4-DIACETYLHEPTANEDINITRILE

Systematic Name

English

NSC-2690

Code

English

HEPTANEDINITRILE, 4,4-DIACETYL-

Systematic Name

English

3,3-BIS(2-CYANOETHYL)-2,4-PENTANEDIONE

Systematic Name

English

Code System Code Type Description

FDA UNII

X1LM63FW5U

Created by admin on Sat Dec 16 12:45:10 GMT 2023 , Edited by admin on Sat Dec 16 12:45:10 GMT 2023

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NSC

2690

Created by admin on Sat Dec 16 12:45:10 GMT 2023 , Edited by admin on Sat Dec 16 12:45:10 GMT 2023

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PUBCHEM

21395

Created by admin on Sat Dec 16 12:45:10 GMT 2023 , Edited by admin on Sat Dec 16 12:45:10 GMT 2023

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CAS

5324-43-6

Created by admin on Sat Dec 16 12:45:10 GMT 2023 , Edited by admin on Sat Dec 16 12:45:10 GMT 2023

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EPA CompTox

DTXSID60201334

Created by admin on Sat Dec 16 12:45:10 GMT 2023 , Edited by admin on Sat Dec 16 12:45:10 GMT 2023

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