ISOPENTYL NITRITE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H11NO2
Molecular Weight	117.1463
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOPENTYL NITRITE

Structure Search

SMILES

CC(C)CCON=O

InChI

InChIKey=OWFXIOWLTKNBAP-UHFFFAOYSA-N

InChI=1S/C5H11NO2/c1-5(2)3-4-8-6-7/h5H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C5H11NO2
Molecular Weight	117.1463
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 `Fri Dec 15 15:39:27 UTC 2023` Edited by `admin` on `Fri Dec 15 15:39:27 UTC 2023`
Record UNII	5N0U5TUC9Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOPENTYL NITRITE

Systematic Name

English

3-METHYLBUTANOL NITRITE

Systematic Name

English

ISOAMYL NITRITE

Systematic Name

English

AMYL NITRITE [HSDB]

Common Name

English

3-METHYLBUTYL NITRITE

Systematic Name

English

NITROUS ACID, 3-METHYLBUTYL ESTER

Common Name

English

ISOAMYL NITRITE [MI]

Common Name

English

NITROUS ACID, ISOPENTYL ESTER

Common Name

English

NSC-7903

Code

English

ISOPENTYL ALCOHOL, NITRITE

Systematic Name

English

AMYL NITRITE [JAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

Code System Code Type Description

NSC

7903

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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DRUG BANK

DB01612

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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MERCK INDEX

m6438

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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Merck Index

CAS

110-46-3

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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ECHA (EC/EINECS)

203-770-8

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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PUBCHEM

8053

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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FDA UNII

5N0U5TUC9Z

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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HSDB

606

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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NCI_THESAURUS

C87283

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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MESH

C048958

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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CHEBI

2691

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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EPA CompTox

DTXSID9025455

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

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