3-Nitrobenzyl acetate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9NO4
Molecular Weight	195.1721
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=WNVPZUAAKWXDNS-UHFFFAOYSA-N

InChI=1S/C9H9NO4/c1-7(11)14-6-8-3-2-4-9(5-8)10(12)13/h2-5H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H9NO4
Molecular Weight	195.1721
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 10:57:53 GMT 2023` Edited by `admin` on `Sat Dec 16 10:57:53 GMT 2023`
Record UNII	UK7QF6D5CQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Nitrobenzyl acetate

Systematic Name

English

Benzenemethanol, 3-nitro-, 1-acetate

Systematic Name

English

Benzenemethanol, 3-nitro-, acetate (ester)

Systematic Name

English

Benzenemethanol, m-nitro-, acetate (ester)

Common Name

English

m-Nitrobenzyl acetate

Systematic Name

English

Code System Code Type Description

FDA UNII

UK7QF6D5CQ

Created by admin on Sat Dec 16 10:57:53 GMT 2023 , Edited by admin on Sat Dec 16 10:57:53 GMT 2023

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PUBCHEM

155620

Created by admin on Sat Dec 16 10:57:53 GMT 2023 , Edited by admin on Sat Dec 16 10:57:53 GMT 2023

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CAS

21388-97-6

Created by admin on Sat Dec 16 10:57:53 GMT 2023 , Edited by admin on Sat Dec 16 10:57:53 GMT 2023

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EPA CompTox

DTXSID90943937

Created by admin on Sat Dec 16 10:57:53 GMT 2023 , Edited by admin on Sat Dec 16 10:57:53 GMT 2023

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