Thiochroman-4-one

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H8OS
Molecular Weight	164.224
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Thiochroman-4-one

Structure Search

SMILES

O=C1CCSC2=CC=CC=C12

InChI

InChIKey=CVQSWZMJOGOPAV-UHFFFAOYSA-N

InChI=1S/C9H8OS/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2

HIDE SMILES / InChI

Molecular Formula	C9H8OS
Molecular Weight	164.224
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 `Tue Apr 01 19:09:41 GMT 2025` Edited by `admin` on `Tue Apr 01 19:09:41 GMT 2025`
Record UNII	3SZW54A3MY
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-113603

Preferred Name

English

Thiochroman-4-one

Systematic Name

English

4H-1-Benzothiopyran-4-one, 2,3-dihydro-

Systematic Name

English

NSC-64353

Code

English

2,3-Dihydro-4H-1-benzothiopyran-4-one

Systematic Name

English

NSC-153096

Code

English

Code System Code Type Description

ECHA (EC/EINECS)

222-548-1

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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EPA CompTox

DTXSID10188762

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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NSC

153096

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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NSC

113603

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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NSC

64353

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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FDA UNII

3SZW54A3MY

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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PUBCHEM

19048

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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CAS

3528-17-4

Created by admin on Tue Apr 01 19:09:41 GMT 2025 , Edited by admin on Tue Apr 01 19:09:41 GMT 2025

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