M-NITROPHENETHYL ACETATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H11NO4
Molecular Weight	209.1986
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of M-NITROPHENETHYL ACETATE

Structure Search

SMILES

CC(=O)OCCC1=CC(=CC=C1)[N+]([O-])=O

InChI

InChIKey=DHCRSUDNZBCHMQ-UHFFFAOYSA-N

InChI=1S/C10H11NO4/c1-8(12)15-6-5-9-3-2-4-10(7-9)11(13)14/h2-4,7H,5-6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H11NO4
Molecular Weight	209.1986
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 17:35:19 GMT 2025` Edited by `admin` on `Tue Apr 01 17:35:19 GMT 2025`
Record UNII	5MKT2S865H
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BENZENEETHANOL, 3-NITRO-, ACETATE (ESTER)

Preferred Name

English

M-NITROPHENETHYL ACETATE

Systematic Name

English

BENZENEETHANOL, 3-NITRO-, 1-ACETATE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

271-268-6

Created by admin on Tue Apr 01 17:35:19 GMT 2025 , Edited by admin on Tue Apr 01 17:35:19 GMT 2025

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CAS

68527-46-8

Created by admin on Tue Apr 01 17:35:19 GMT 2025 , Edited by admin on Tue Apr 01 17:35:19 GMT 2025

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PUBCHEM

110451

Created by admin on Tue Apr 01 17:35:19 GMT 2025 , Edited by admin on Tue Apr 01 17:35:19 GMT 2025

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EPA CompTox

DTXSID7071600

Created by admin on Tue Apr 01 17:35:19 GMT 2025 , Edited by admin on Tue Apr 01 17:35:19 GMT 2025

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FDA UNII

5MKT2S865H

Created by admin on Tue Apr 01 17:35:19 GMT 2025 , Edited by admin on Tue Apr 01 17:35:19 GMT 2025

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