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SIMAZINE-2-HYDROXY

CAS 2599-11-3C7H13N5OMW 183.21

SIMAZINE-2-HYDROXY (CAS 2599-11-3) — formula C7H13N5O, molecular weight 183.21; category organic chemicals.

Product Overview

CAS Number2599-11-3
Molecular FormulaC7H13N5O
Molecular Weight183.21
LogP0.35
CategoryOrganic Chemicals

Technical Profile

What this product is

SIMAZINE-2-HYDROXY is a carbon-based organic compound with CAS registry number 2599-11-3 and molecular formula C7H13N5O (molecular weight 183.21), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 2599-11-3

Its molecular formula C7H13N5O comprises 7 C, 13 H, 5 N, 1 O atoms.

Also known as: SIMAZINE-2-HYDROXY · 西玛津-2-羟基

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of SIMAZINE-2-HYDROXY?

The CAS registry number of SIMAZINE-2-HYDROXY is 2599-11-3.

What is the molecular formula and molecular weight of SIMAZINE-2-HYDROXY?

Molecular formula C7H13N5O, molecular weight 183.21.

What other names is SIMAZINE-2-HYDROXY known by?

It is also registered under: SIMAZINE-2-HYDROXY, 西玛津-2-羟基.

Which category does SIMAZINE-2-HYDROXY belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for SIMAZINE-2-HYDROXY (CAS 2599-11-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号2599-11-3
PubChem CID135408659
分子式C7H13N5O
IUPAC 名称4,6-bis(ethylamino)-1H-1,3,5-triazin-2-one
UNII(FDA)2MHC1OXH2M

Computed descriptors

Molecular Weight183.21
XLogP3-0.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass183.11201006
Monoisotopic Mass183.11201006
Topological Polar Surface Area77.9
Heavy Atom Count13

Physicochemical values on record

LogP0.35
Collision Cross Section141.28 Ų [M+H]+
Collision Cross Section143.59 Ų [M-H]-

Synonyms and trade names

Hydroxysimazine; SIMAZINE-2-HYDROXY; 2MHC1OXH2M; UNII-2MHC1OXH2M; NSC-56447; 1,3,5-Triazin-2(1H)-one, 4,6-bis(ethylamino)-; s-Triazin-2-ol, 4,6-bis(ethylamino)-; CHEBI:83476; NSC 56447; SYSTEMATIC NAMES 1,3,5-TRIAZIN-2(1H)-ONE, 4,6-BIS(ETHYLAMINO)-; DTXSID001017842; RefChem:147276; DTXCID401476024; s-Triazin-2-ol, 4,6-bis(ethylamino)-(8CI); YQIXRXMOJFQVBV-UHFFFAOYSA-N; 2-Hydroxysimazine

GHS hazard classification

已通报的危害声明H302 (100%), H319 (100%)

What the public record says

西玛津-2-羟基 · CAS 2599-11-3 · C7H13N5O. UNII 2MHC1OXH2M. LogP: 0.35; Collision Cross Section: 141.28 Ų [M+H]+; Collision Cross Section: 143.59 Ų [M-H]-.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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