5-TERT-BUTYL-4,6-DINITRO-M-XYLENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H16N2O4
Molecular Weight	252.2664
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-TERT-BUTYL-4,6-DINITRO-M-XYLENE

Structure Search

SMILES

CC1=CC(C)=C(C(=C1[N+]([O-])=O)C(C)(C)C)[N+]([O-])=O

InChI

InChIKey=ZHFGLQLHVTZCGJ-UHFFFAOYSA-N

InChI=1S/C12H16N2O4/c1-7-6-8(2)11(14(17)18)9(12(3,4)5)10(7)13(15)16/h6H,1-5H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

5-TERT-BUTYL-4,6-DINITRO-M-XYLENE

Systematic Name

English

3-(1,1-DIMETHYLETHYL)-1,5-DIMETHYL-2,4-DINITROBENZENE

Systematic Name

English

BENZENE, 3-(1,1-DIMETHYLETHYL)-1,5-DIMETHYL-2,4-DINITRO-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

282-822-1

Created by admin on Sat Dec 16 12:46:26 GMT 2023 , Edited by admin on Sat Dec 16 12:46:26 GMT 2023

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EPA CompTox

DTXSID50233402

Created by admin on Sat Dec 16 12:46:26 GMT 2023 , Edited by admin on Sat Dec 16 12:46:26 GMT 2023

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CAS

84434-22-0

Created by admin on Sat Dec 16 12:46:26 GMT 2023 , Edited by admin on Sat Dec 16 12:46:26 GMT 2023

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FDA UNII

LR57TMF6F3

Created by admin on Sat Dec 16 12:46:26 GMT 2023 , Edited by admin on Sat Dec 16 12:46:26 GMT 2023

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PUBCHEM

3019859

Created by admin on Sat Dec 16 12:46:26 GMT 2023 , Edited by admin on Sat Dec 16 12:46:26 GMT 2023

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SUBSTANCE RECORD


					LR57TMF6F3

5-TERT-BUTYL-4,6-DINITRO-M-XYLENE