3-Thiocyanato-2-propenoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H3NO2S
Molecular Weight	129.137
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3-Thiocyanato-2-propenoic acid

Structure Search

SMILES

OC(=O)C=CSC#N

InChI

InChIKey=OQYPGQSDSUQZBM-OWOJBTEDSA-N

InChI=1S/C4H3NO2S/c5-3-8-2-1-4(6)7/h1-2H,(H,6,7)/b2-1+

HIDE SMILES / InChI

Molecular Formula	C4H3NO2S
Molecular Weight	129.137
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:03:18 GMT 2025` Edited by `admin` on `Wed Apr 02 12:03:18 GMT 2025`
Record UNII	X5VW2SN8Q8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Thiocyanato-2-propenoic acid

Systematic Name

English

NSC-195458

Preferred Name

English

2-Propenoic acid, 3-thiocyanato-

Systematic Name

English

Code System Code Type Description

PUBCHEM

304270

Created by admin on Wed Apr 02 12:03:18 GMT 2025 , Edited by admin on Wed Apr 02 12:03:18 GMT 2025

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CAS

65200-27-3

Created by admin on Wed Apr 02 12:03:18 GMT 2025 , Edited by admin on Wed Apr 02 12:03:18 GMT 2025

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EPA CompTox

DTXSID90419445

Created by admin on Wed Apr 02 12:03:18 GMT 2025 , Edited by admin on Wed Apr 02 12:03:18 GMT 2025

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FDA UNII

X5VW2SN8Q8

Created by admin on Wed Apr 02 12:03:18 GMT 2025 , Edited by admin on Wed Apr 02 12:03:18 GMT 2025

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NSC

195458

Created by admin on Wed Apr 02 12:03:18 GMT 2025 , Edited by admin on Wed Apr 02 12:03:18 GMT 2025

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