BUTYL ISOCYANATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H9NO
Molecular Weight	99.1311
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

SMILES

CCCCN=C=O

InChI

InChIKey=HNHVTXYLRVGMHD-UHFFFAOYSA-N

InChI=1S/C5H9NO/c1-2-3-4-6-5-7/h2-4H2,1H3

HIDE SMILES / InChI

Approval Year

PubMed

Show entries

Title	Date	PubMed
Use of hexyl isocyanate antigen to detect antibodies to hexamethylene diisocyanate (HDI) in sensitized guinea pigs and in a sensitized worker.	1982 May-Jun	6821040
Butyl isocyanide as a probe of the activation mechanism of soluble guanylate cyclase. Investigating the role of non-heme nitric oxide.	2007 Dec 7	17916555
Toxic effects of carbendazim and n-butyl isocyanate, metabolites of the fungicide benomyl, on early development in the African clawed frog, Xenopus laevis.	2008 Feb	18214921
Mesoporous hybrid materials containing nanoscopic "binding pockets" for colorimetric anion signaling in water by using displacement assays.	2009 Sep 14	19650095
Stereoselective inhibition of butyrylcholinesterase by enantiomers of exo- and endo-2-norbornyl-N-n-butylcarbamates.	2010 Feb	20030505

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Name

Type

Language

BUTYL ISOCYANATE

Systematic Name

English

ISOCYANIC ACID BUTYL ESTER

Systematic Name

English

BUTYL ISOCYANATE [MI]

Common Name

English

BUTANE, 1-ISOCYANATO-

Systematic Name

English

N-BUTYL ISOCYANATE [HSDB]

Common Name

English

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Code System

Code

Type

Description

MERCK INDEX

m2848

PRIMARY

Merck Index

EPA CompTox

DTXSID6026872

PRIMARY

CAS

111-36-4

PRIMARY

HSDB

5548

PRIMARY

FDA UNII

XM89T89J3W

PRIMARY

Showing 1 to 5 of 9 entries

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SUBSTANCE RECORD


					XM89T89J3W

BUTYL ISOCYANATE

SMILES

InChI

Approval Year

PubMed

Patents