1,6-DINITROPYRENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H8N2O4
Molecular Weight	292.2457
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,6-DINITROPYRENE

Structure Search

SMILES

[O-][N+](=O)C1=CC=C2C=CC3=C4C(C=CC1=C24)=CC=C3[N+]([O-])=O

InChI

InChIKey=GUXACCKTQWVTLG-UHFFFAOYSA-N

InChI=1S/C16H8N2O4/c19-17(20)13-8-4-10-2-6-12-14(18(21)22)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H

HIDE SMILES / InChI

Molecular Formula	C16H8N2O4
Molecular Weight	292.2457
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 `Fri Dec 15 17:19:15 UTC 2023` Edited by `admin` on `Fri Dec 15 17:19:15 UTC 2023`
Record UNII	66Q2ZUF83N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,6-DINITROPYRENE

Systematic Name

English

1,6-DINITROPYRENE [HSDB]

Common Name

English

PYRENE, 1,6-DINITRO-

Systematic Name

English

DINITROPYRENE, 1,6-

Systematic Name

English

1,6-DINITROPYRENE [IARC]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C45182

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

Code System Code Type Description

PUBCHEM

39184

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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MESH

C033309

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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HSDB

7874

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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FDA UNII

66Q2ZUF83N

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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NCI_THESAURUS

C44299

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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CAS

42397-64-8

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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EPA CompTox

DTXSID90872819

Created by admin on Fri Dec 15 17:19:15 UTC 2023 , Edited by admin on Fri Dec 15 17:19:15 UTC 2023

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