4-Hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanone

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H13N3O3
Molecular Weight	223.2285
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanone

Structure Search

SMILES

CN(N=O)C(O)CCC(=O)C1=CN=CC=C1

InChI

InChIKey=UIPLZNGNFRQXQE-UHFFFAOYSA-N

InChI=1S/C10H13N3O3/c1-13(12-16)10(15)5-4-9(14)8-3-2-6-11-7-8/h2-3,6-7,10,15H,4-5H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H13N3O3
Molecular Weight	223.2285
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:45:19 GMT 2025` Edited by `admin` on `Wed Apr 02 18:45:19 GMT 2025`
Record UNII	E8NBT83G48
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Butanone, 4-hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-

Preferred Name

English

4-Hydroxy-4-(methylnitrosoamino)-1-(3-pyridinyl)-1-butanone

Systematic Name

English

N-(1-hydroxy-4-oxo-4-pyridin-3-ylbutyl)-N-methylnitrousamide

Systematic Name

English

Code System Code Type Description

FDA UNII

E8NBT83G48

Created by admin on Wed Apr 02 18:45:19 GMT 2025 , Edited by admin on Wed Apr 02 18:45:19 GMT 2025

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PUBCHEM

53297439

Created by admin on Wed Apr 02 18:45:19 GMT 2025 , Edited by admin on Wed Apr 02 18:45:19 GMT 2025

PRIMARY

EPA CompTox

DTXSID30693262

Created by admin on Wed Apr 02 18:45:19 GMT 2025 , Edited by admin on Wed Apr 02 18:45:19 GMT 2025

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CAS

136004-00-7

Created by admin on Wed Apr 02 18:45:19 GMT 2025 , Edited by admin on Wed Apr 02 18:45:19 GMT 2025

PRIMARY

Related Record Type Details


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4-(N-NITROSOMETHYLAMINO)-1-(3-PYRIDYL)-1-BUTANONE

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Comments:

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Amount: