6-THIOCYANATO-THYMOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H13NOS
Molecular Weight	207.292
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-THIOCYANATO-THYMOL

Structure Search

SMILES

CC(C)C1=C(O)C=C(C)C(SC#N)=C1

InChI

InChIKey=JCBPZRGUDJXNCD-UHFFFAOYSA-N

InChI=1S/C11H13NOS/c1-7(2)9-5-11(14-6-12)8(3)4-10(9)13/h4-5,7,13H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H13NOS
Molecular Weight	207.292
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 19:57:04 GMT 2025` Edited by `admin` on `Tue Apr 01 19:57:04 GMT 2025`
Record UNII	L73342S8Y2
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

6-THIOCYANATO-THYMOL

Systematic Name

English

NSC-31029

Preferred Name

English

THIOCYANIC ACID, 5-HYDROXYCARVACRYL ESTER

Systematic Name

English

THIOCYANIC ACID, 4-HYDROXY-2-METHYL-5-(1-METHYLETHYL)PHENYL ESTER

Systematic Name

English

NSC-4698

Code

English

Code System Code Type Description

PUBCHEM

94837

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

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EPA CompTox

DTXSID50209561

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

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FDA UNII

L73342S8Y2

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

PRIMARY

CAS

6074-31-3

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

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NSC

31029

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

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NSC

4698

Created by admin on Tue Apr 01 19:57:04 GMT 2025 , Edited by admin on Tue Apr 01 19:57:04 GMT 2025

PRIMARY