Misplaced Pages

:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox - Misplaced Pages

Article snapshot taken from Wikipedia with creative commons attribution-sharealike license. Give it a read and then ask your questions in the chat. We can research this topic together.
< Misplaced Pages:WikiProject Chemicals | Chembox validation

This is an old revision of this page, as edited by Beetstra (talk | contribs) at 13:14, 24 November 2011 (Saving copy of the {{chembox}} taken from revid 432156544 of page Myclobutanil for the Chem/Drugbox validation project (updated: 'ChemSpiderID', 'StdInChI', 'StdInChIKey').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 13:14, 24 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 432156544 of page Myclobutanil for the Chem/Drugbox validation project (updated: 'ChemSpiderID', 'StdInChI', 'StdInChIKey').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 432156544 of page Myclobutanil with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Kekulé, skeletal formula of myclobutanil
Names
Preferred IUPAC name 2-p-Chlorophenyl-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile
Systematic IUPAC name 2-(4-Chlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)hexanenitrile
Other names 2-(4-Chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile
Identifiers
CAS Number
3D model (JSmol)
Beilstein Reference 7138849
ChemSpider
EC Number
  • 410-400-0
KEGG
MeSH Systhane
PubChem CID
RTECS number
  • XZ5257000
UN number 3077
InChI
  • InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3/t15-/m0/s1Key: HZJKXKUJVSEEFU-HNNXBMFYSA-N
SMILES
  • CCCCC(Cn1cncn1)(C#N)c1ccc(Cl)cc1
Properties
Chemical formula C15H17ClN4
Molar mass 288.78 g·mol
Appearance Pale, yellow, translucent crystals
Solubility in water 142 mg dm
Hazards
GHS labelling:
Pictograms GHS07: Exclamation mark GHS08: Health hazard GHS09: Environmental hazard
Signal word Warning
Hazard statements H302, H319, H361, H411
Precautionary statements P273, P281, P305+P351+P338
NFPA 704 (fire diamond)
NFPA 704 four-colored diamondHealth 2: Intense or continued but not chronic exposure could cause temporary incapacitation or possible residual injury. E.g. chloroformFlammability 1: Must be pre-heated before ignition can occur. Flash point over 93 °C (200 °F). E.g. canola oilInstability 0: Normally stable, even under fire exposure conditions, and is not reactive with water. E.g. liquid nitrogenSpecial hazards (white): no code
2 1 0
Flash point >100 °C
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). ☒N verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound