3,5,6-Trimethyl-2-nitrobenzofuran

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H11NO3
Molecular Weight	205.2099
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5,6-Trimethyl-2-nitrobenzofuran

Structure Search

SMILES

CC1=C(OC2=C1C=C(C)C(C)=C2)[N+]([O-])=O

InChI

InChIKey=PSGGVEHPNBDJNA-UHFFFAOYSA-N

InChI=1S/C11H11NO3/c1-6-4-9-8(3)11(12(13)14)15-10(9)5-7(6)2/h4-5H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H11NO3
Molecular Weight	205.2099
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 19:36:13 GMT 2025` Edited by `admin` on `Tue Apr 01 19:36:13 GMT 2025`
Record UNII	2TE9DM7SP5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-170696

Preferred Name

English

3,5,6-Trimethyl-2-nitrobenzofuran

Systematic Name

English

2-Nitro-3,5,6-trimethylbenzofuran

Systematic Name

English

Benzofuran, 3,5,6-trimethyl-2-nitro-

Systematic Name

English

Benzofuran, 2-nitro-3,5,6-trimethyl-

Systematic Name

English

Code System Code Type Description

FDA UNII

2TE9DM7SP5

Created by admin on Tue Apr 01 19:36:13 GMT 2025 , Edited by admin on Tue Apr 01 19:36:13 GMT 2025

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CAS

27408-70-4

Created by admin on Tue Apr 01 19:36:13 GMT 2025 , Edited by admin on Tue Apr 01 19:36:13 GMT 2025

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PUBCHEM

33806

Created by admin on Tue Apr 01 19:36:13 GMT 2025 , Edited by admin on Tue Apr 01 19:36:13 GMT 2025

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EPA CompTox

DTXSID90181832

Created by admin on Tue Apr 01 19:36:13 GMT 2025 , Edited by admin on Tue Apr 01 19:36:13 GMT 2025

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NSC

170696

Created by admin on Tue Apr 01 19:36:13 GMT 2025 , Edited by admin on Tue Apr 01 19:36:13 GMT 2025

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