1,3-Dioxan-5-yl 3-pyridyl ketone

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H11NO3
Molecular Weight	193.1992
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-Dioxan-5-yl 3-pyridyl ketone

Structure Search

SMILES

O=C(C1COCOC1)C2=CC=CN=C2

InChI

InChIKey=AXYFGZWOQMDXSW-UHFFFAOYSA-N

InChI=1S/C10H11NO3/c12-10(8-2-1-3-11-4-8)9-5-13-7-14-6-9/h1-4,9H,5-7H2

HIDE SMILES / InChI

Molecular Formula	C10H11NO3
Molecular Weight	193.1992
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 12:32:58 GMT 2023` Edited by `admin` on `Sat Dec 16 12:32:58 GMT 2023`
Record UNII	K3759D9XE5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,3-Dioxan-5-yl 3-pyridyl ketone

Systematic Name

English

Methanone, 1,3-dioxan-5-yl-3-pyridinyl-

Systematic Name

English

1,3-Dioxan-5-yl-3-pyridinylmethanone

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

288-445-9

Created by admin on Sat Dec 16 12:32:58 GMT 2023 , Edited by admin on Sat Dec 16 12:32:58 GMT 2023

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FDA UNII

K3759D9XE5

Created by admin on Sat Dec 16 12:32:58 GMT 2023 , Edited by admin on Sat Dec 16 12:32:58 GMT 2023

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CAS

85727-04-4

Created by admin on Sat Dec 16 12:32:58 GMT 2023 , Edited by admin on Sat Dec 16 12:32:58 GMT 2023

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EPA CompTox

DTXSID40235036

Created by admin on Sat Dec 16 12:32:58 GMT 2023 , Edited by admin on Sat Dec 16 12:32:58 GMT 2023

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PUBCHEM

11970996

Created by admin on Sat Dec 16 12:32:58 GMT 2023 , Edited by admin on Sat Dec 16 12:32:58 GMT 2023

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