Misplaced Pages:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox: Difference between revisions

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Revision as of 15:54, 6 December 2011 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 444111851 of page Sodium_pyruvate for the Chem/Drugbox validation project (updated: 'ChEMBL').← Previous edit		Revision as of 15:54, 6 December 2011 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 444151762 of page Sodium_salicylate for the Chem/Drugbox validation project (updated: 'ChEMBL', 'KEGG').Next edit →
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	{{ambox \| text = This page contains a copy of the infobox ({{tl\|chembox}}) taken from revid of page ] with values updated to verified values.}}		{{ambox \| text = This page contains a copy of the infobox ({{tl\|chembox}}) taken from revid of page ] with values updated to verified values.}}
	{{chembox		{{chembox
	\| verifiedrevid = ~~444110012~~		\| verifiedrevid = 401613201
		⚫	\| ImageFile = SodiumSalicylate.png
	\| Name = Sodium pyruvate
			\| ImageSize =
⚫	\| ImageFile = ~~Sodium pyruvate~~.png
			\| IUPACName = Sodium salicylate
	\| ImageFileL1 = Pyruvate-3D-balls.png
			\| OtherNames = Salsonin, Monosodium salicylate, Sodium o-hydroxybenzoate, Sodium 2-hydroxybenzoate, Salicylic acid sodium salt, Monosodium 2-hydroxybenzoate, Diuratin, [http://ChEMBL = 447868
	\| ImageSizeL1 = 160px
			\| PubChem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5900&ncount=51#Synonyms ...]
	\| ImageNameL1 = Ball-and-stick model of the pyruvate anion
	\| ImageFileR1 = Sodium-3D.png
	\| ImageSizeR1 = 80px
	\| ImageNameR1 = The sodium cation
	\| OtherNames = α-ketopropionic acid sodium salt
	2-oxopropanoic acid sodium salt

	Pyruvic acid sodium salt
	\| Section1 = {{Chembox Identifiers		\| Section1 = {{Chembox Identifiers
	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}		\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ChemSpiderID = ~~7931~~		\| ChemSpiderID = 5689
⚫	\| ChEMBL = ~~181886~~
⚫	\| PubChem = ~~8224~~
	\| UNII_Ref = {{fdacite\|correct\|FDA}}		\| UNII_Ref = {{fdacite\|correct\|FDA}}
	\| UNII = ~~POD38AIF08~~		\| UNII = WIQ1H85SYP
	\| ~~InChI~~ = 1/~~C3H4O3~~.Na/c1-2(4)3(5)6;/~~h1H3~~,(H,5,6);/q;+1/p-1		\| InChI1 = 1/C7H6O3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
			\| InChIKey1 = ABBQHOQBGMUPJH-REWHXWOFAO
	\| InChIKey = DAEPDZWVDSPTHF-REWHXWOFAL
	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| ChEBI = 50144
⚫	\| SMILES = .C(=O)C(=O)C
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/~~C3H4O3~~.Na/c1-2(4)3(5)6;/~~h1H3~~,(H,5,6);/q;+1/p-1		\| StdInChI = 1S/C7H6O3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~DAEPDZWVDSPTHF~~-UHFFFAOYSA-M		\| StdInChIKey = ABBQHOQBGMUPJH-UHFFFAOYSA-M
	\| CASNo_Ref = {{cascite\|correct\|CAS}}		\| CASNo_Ref = {{cascite\|correct\|CAS}}
	\| CASNo = ~~113~~-24-6		\| CASNo = 54-21-7
			\| EINECS = 200-198-0
		⚫	\| ChEMBL = 447868
		⚫	\| PubChem = 5900
			\| DrugBank = DB01398
		⚫	\| SMILES = .O=C()c1ccccc1O
			\| InChI = 1/C7H6O3.Na/c8-6-4-2-1- 3-5(6)7(9)10;/h1-4,8H,(H,9,10); /q;+1/p-1/fC7H5O3.Na/q-1;m
			\| KEGG = <!-- blanked - oldvalue: D00566 -->
			\| RTECS = VO5075000
	}}		}}
	\| Section2 = {{Chembox Properties		\| Section2 = {{Chembox Properties
	\| Formula = C<sub>3</sub>H<sub>3</sub>NaO<sub>3</sub>		\| Formula = C<sub>7</sub>H<sub>5</sub>NaO<sub>3</sub>
	\| MolarMass = ~~110~~.0 g/mol		\| MolarMass = 160.11 g/mol
			\| Appearance = White crystals
⚫	\| ~~Density~~ =
	\| ~~Solvent~~ = ~~other solvents~~		\| Density =
	\| ~~SolubleOther~~ = ~~100~~ ~~mg/mL~~		\| MeltingPt = 200 °C
	\| ~~MeltingPt~~ =		\| BoilingPt =
			\| Solubility = ~ 660 g/l at 20 °C
	\| BoilingPt =}}
			}}
			\| Section3 = {{Chembox Hazards
			\| MainHazards = Harmful
		⚫	\| FlashPt =
			\| Autoignition = > 250 °C
			\| NFPA-H = 1
			\| NFPA-F = 1
			\| NFPA-R = 0
			\| NFPA-O =
			\| RPhrases = {{R22}}, {{R36/37/38}}
			\| SPhrases = {{S24/25}}, {{S26}}, {{S36/37/39}}
			}}
	}}		}}

Revision as of 15:54, 6 December 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 444151762 of page Sodium_salicylate with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names

IUPAC name Sodium salicylate
Other names Salsonin, Monosodium salicylate, Sodium o-hydroxybenzoate, Sodium 2-hydroxybenzoate, Salicylic acid sodium salt, Monosodium 2-hydroxybenzoate, Diuratin, [http://ChEMBL = 447868
Identifiers
CAS Number	54-21-7
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL447868
ChemSpider	5689
DrugBank	DB01398
EC Number	200-198-0
PubChem CID	5900
RTECS number	VO5075000
UNII	WIQ1H85SYP
InChI InChI=1S/C7H6O3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M InChI=1/C7H6O3.Na/c8-6-4-2-1- 3-5(6)7(9)10;/h1-4,8H,(H,9,10); /q;+1/p-1/fC7H5O3.Na/q-1;m InChI=1/C7H6O3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1Key: ABBQHOQBGMUPJH-REWHXWOFAO
SMILES .O=C()c1ccccc1O
Properties
Chemical formula	C₇H₅NaO₃
Molar mass	160.11 g/mol
Appearance	White crystals
Melting point	200 °C
Solubility in water	~ 660 g/l at 20 °C
Hazards
Occupational safety and health (OHS/OSH):
Main hazards	Harmful
NFPA 704 (fire diamond)	1 1 0
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Y verify (what is ?) Infobox references

Chemical compound