PENTAMETHYLMELAMINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H16N6
Molecular Weight	196.2528
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENTAMETHYLMELAMINE

Structure Search

SMILES

CNC1=NC(=NC(=N1)N(C)C)N(C)C

InChI

InChIKey=XIFVTSIIYVGRHJ-UHFFFAOYSA-N

InChI=1S/C8H16N6/c1-9-6-10-7(13(2)3)12-8(11-6)14(4)5/h1-5H3,(H,9,10,11,12)

HIDE SMILES / InChI

Molecular Formula	C8H16N6
Molecular Weight	196.2528
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 `Fri Dec 15 19:42:13 UTC 2023` Edited by `admin` on `Fri Dec 15 19:42:13 UTC 2023`
Record UNII	UEF6R96K8R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAMETHYLMELAMINE

Common Name

English

MELAMINE, PENTAMETHYL-

Common Name

English

NSC-654383

Code

English

1,3,5-TRIAZINE-2,4,6-TRIAMINE, N,N,N',N',N''-PENTAMETHYL-

Systematic Name

English

1,3,5-TRIAZINE-2,4,6-TRIAMINE, N2,N4,N4,N6,N6-PENTAMETHYL-

Systematic Name

English

UNT-51239

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C292

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

Code System Code Type Description

PUBCHEM

27775

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

PRIMARY

EPA CompTox

DTXSID80167428

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

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NCI_THESAURUS

C1189

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

PRIMARY

FDA UNII

UEF6R96K8R

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

PRIMARY

MESH

C022048

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

PRIMARY

NSC

654383

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

PRIMARY

CAS

16268-62-5

Created by admin on Fri Dec 15 19:42:13 UTC 2023 , Edited by admin on Fri Dec 15 19:42:13 UTC 2023

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Related Record Type Details


					MVW40QV81B

PENTAMETHYLMELAMINE HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Related Record Type Details


					Q8BIH59O7H

PARENT -> METABOLITE

Comments:

This metabolite can generate electriphilic iminum species that are capable of reacting covalently with DNAguanine and cytosine residues, as well as protein.

Qualification:

URINE