4,5,6,7-Tetrahydro-1H-benzotriazole

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H9N3
Molecular Weight	123.1558
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,5,6,7-Tetrahydro-1H-benzotriazole

Structure Search

SMILES

C1CCC2=C(C1)NN=N2

InChI

InChIKey=CKRLKUOWTAEKKX-UHFFFAOYSA-N

InChI=1S/C6H9N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H2,(H,7,8,9)

HIDE SMILES / InChI

Molecular Formula	C6H9N3
Molecular Weight	123.1558
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 `Mon Mar 31 21:54:37 GMT 2025` Edited by `admin` on `Mon Mar 31 21:54:37 GMT 2025`
Record UNII	JYP449D5Y3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Benzotriazole, 4,5,6,7-tetrahydro-

Preferred Name

English

4,5,6,7-Tetrahydro-1H-benzotriazole

Common Name

English

Code System Code Type Description

PUBCHEM

81247

Created by admin on Mon Mar 31 21:54:37 GMT 2025 , Edited by admin on Mon Mar 31 21:54:37 GMT 2025

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FDA UNII

JYP449D5Y3

Created by admin on Mon Mar 31 21:54:37 GMT 2025 , Edited by admin on Mon Mar 31 21:54:37 GMT 2025

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CAS

6789-99-7

Created by admin on Mon Mar 31 21:54:37 GMT 2025 , Edited by admin on Mon Mar 31 21:54:37 GMT 2025

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ECHA (EC/EINECS)

229-858-6

Created by admin on Mon Mar 31 21:54:37 GMT 2025 , Edited by admin on Mon Mar 31 21:54:37 GMT 2025

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EPA CompTox

DTXSID4064476

Created by admin on Mon Mar 31 21:54:37 GMT 2025 , Edited by admin on Mon Mar 31 21:54:37 GMT 2025

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