3,5-DINITROBENZYL ALCOHOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H6N2O5
Molecular Weight	198.1329
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-DINITROBENZYL ALCOHOL

Structure Search

SMILES

OCC1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=GPHYIQCSMDYRGJ-UHFFFAOYSA-N

InChI=1S/C7H6N2O5/c10-4-5-1-6(8(11)12)3-7(2-5)9(13)14/h1-3,10H,4H2

HIDE SMILES / InChI

Molecular Formula	C7H6N2O5
Molecular Weight	198.1329
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 12:01:06 GMT 2023` Edited by `admin` on `Sat Dec 16 12:01:06 GMT 2023`
Record UNII	111Z6Y5YNW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,5-DINITROBENZYL ALCOHOL

Systematic Name

English

3,5-DINITROBENZENEMETHANOL

Systematic Name

English

BENZENEMETHANOL, 3,5-DINITRO-

Systematic Name

English

BENZYL ALCOHOL, 3,5-DINITRO-

Systematic Name

English

Code System Code Type Description

FDA UNII

111Z6Y5YNW

Created by admin on Sat Dec 16 12:01:06 GMT 2023 , Edited by admin on Sat Dec 16 12:01:06 GMT 2023

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PUBCHEM

116978

Created by admin on Sat Dec 16 12:01:06 GMT 2023 , Edited by admin on Sat Dec 16 12:01:06 GMT 2023

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EPA CompTox

DTXSID90221262

Created by admin on Sat Dec 16 12:01:06 GMT 2023 , Edited by admin on Sat Dec 16 12:01:06 GMT 2023

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CAS

71022-43-0

Created by admin on Sat Dec 16 12:01:06 GMT 2023 , Edited by admin on Sat Dec 16 12:01:06 GMT 2023

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ECHA (EC/EINECS)

275-131-1

Created by admin on Sat Dec 16 12:01:06 GMT 2023 , Edited by admin on Sat Dec 16 12:01:06 GMT 2023

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