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Revision as of 15:44, 16 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 443259919 of page 1-Pyrroline-5-carboxylic_acid for the Chem/Drugbox validation project (updated: 'CASNo').← Previous edit		Revision as of 15:44, 16 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 471731941 of page 1-Naphthaleneacetic_acid for the Chem/Drugbox validation project (updated: '').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
			\| Verifiedfields = changed
	\| verifiedrevid = ~~443258579~~		\| verifiedrevid = 457306408
	\|ImageFile=Delta-1-pyrroline-5-carboxylic acid.svg
			\| Name = 1-Naphthaleneacetic acid
⚫	\|ImageSize=
			\| ImageFile = Kwas_naftylooctowy.svg
	\|IUPACName=3,4-dihydro-2H-pyrrole-2-carboxylic acid
		⚫	\| ImageSize = 200px
	\|OtherNames=
			\| ImageName = 1-Naphthaleneacetic acid
⚫	\|Section1= {{Chembox Identifiers
			\| IUPACName = 2-(1-Naphthyl)acetic acid
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
			\| OtherNames = 1-Naphthaleneacetic acid<br/>α-Naphthaleneacetic acid<br />Naphthylacetic acid<br />NAA
⚫	\| ChEBI_Ref = {{ebicite\|~~correct~~\|EBI}}
		⚫	\| Section1 = {{Chembox Identifiers
⚫	\| ChEBI = ~~1372~~
			\| DrugBank_Ref = {{drugbankcite\|changed\|drugbank}}
⚫	\| ChemSpiderID = ~~1159~~
			\| DrugBank = DB01750
			\| SMILES = O=C(O)Cc2cccc1ccccc12
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
		⚫	\| ChEBI_Ref = {{ebicite\|changed\|EBI}}
		⚫	\| ChEBI = 32918
		⚫	\| ChemSpiderID = 6601
	\| KEGG_Ref = {{keggcite\|correct\|kegg}}		\| KEGG_Ref = {{keggcite\|correct\|kegg}}
	\| KEGG = ~~C04322~~		\| KEGG = D01558
	\| InChI = 1/~~C5H7NO2~~/c7-5(8)4-2-1-3-6-4~~/h3~~-~~4H,~~1-~~2H2~~,(H,7,8)		\| InChI = 1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)
	\| InChIKey = ~~DWAKNKKXGALPNW~~-~~UHFFFAOYAB~~		\| InChIKey = PRPINYUDVPFIRX-UHFFFAOYAF
		⚫	\| ChEMBL_Ref = {{ebicite\|changed\|EBI}}
	\| SMILES1 = O=C(O)C1/N=C\CC1
		⚫	\| ChEMBL = 428495
⚫	\| ChEMBL_Ref = {{ebicite\|~~correct~~\|EBI}}
		⚫	\| StdInChI_Ref = {{stdinchicite\|changed\|chemspider}}
⚫	\| ChEMBL = ~~1161508~~
		⚫	\| StdInChI = 1S/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)
⚫	\| StdInChI_Ref = {{stdinchicite\|~~correct~~\|chemspider}}
		⚫	\| StdInChIKey_Ref = {{stdinchicite\|changed\|chemspider}}
⚫	\| StdInChI = 1S/~~C5H7NO2~~/c7-5(8)4-2-1-3-6-4~~/h3~~-~~4H,~~1-~~2H2~~,(H,7,8)
		⚫	\| StdInChIKey = PRPINYUDVPFIRX-UHFFFAOYSA-N
⚫	\| StdInChIKey_Ref = {{stdinchicite\|~~correct~~\|chemspider}}
			\| CASNo_Ref = {{cascite\|correct\|CAS}}
⚫	\| StdInChIKey = ~~DWAKNKKXGALPNW~~-UHFFFAOYSA-N
		⚫	\| PubChem = 6862
	\| CASNo = <!-- blanked - oldvalue: 2906-39-0 -->
			\| CASNo = 86-87-3
⚫	\| PubChem=~~1196~~
			\| References = <ref></ref>
	\| SMILES=C1CC(N=C1)C(=O)O
			\| RTECS =
	\| MeSHName=Delta-1-pyrroline-5-carboxylate
	}}		}}
	\|Section2= {{Chembox Properties		\| Section2 = {{Chembox Properties
	\| Formula=C<sub>5</sub>H<sub>7</sub>NO<sub>2</sub>		\| Formula = C<sub>12</sub>H<sub>10</sub>O<sub>2</sub>
	\| MolarMass=~~113~~.~~115~~ g/mol		\| MolarMass = 186.2066 g/mol
	\| Appearance=		\| Appearance = White powder
	\| Density=		\| Density =
			\| Solubility = 0.38 g/L (17 °C)
	\| MeltingPt=		\| MeltingPt = 135 °C
	\| BoilingPt=
	\| ~~Solubility~~=		\| BoilingPt =
			\| pKa = 4.24 (25 °C)<ref>''J. Chem. Soc.'' (1954) 4102</ref>
			\| Viscosity =
	}}		}}
	\|Section3= {{Chembox ~~Hazards~~		\| Section3 = {{Chembox Structure
	\| ~~MainHazards~~=		\| MolShape =
	\| ~~FlashPt~~=		\| Dipole =
			}}
	\| Autoignition=
			\| Section7 = {{Chembox Hazards
			\| ExternalMSDS =
			\| MainHazards =
			\| FlashPt =
			\| RPhrases =
			\| SPhrases =
			}}
			\| Section8 = {{Chembox Related
			\| OtherAnions =
			\| OtherCations =
			\| Function = ]s
			\| OtherFunctn = ]
			\| OtherCpds =
	}}		}}
	}}		}}

Revision as of 15:44, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 471731941 of page 1-Naphthaleneacetic_acid with values updated to verified values.

1-Naphthaleneacetic acid
Names

IUPAC name 2-(1-Naphthyl)acetic acid
Other names 1-Naphthaleneacetic acid α-Naphthaleneacetic acid Naphthylacetic acid NAA
Identifiers
CAS Number	86-87-3
3D model (JSmol)	Interactive image
ChEBI	CHEBI:32918
ChEMBL	ChEMBL428495
ChemSpider	6601
DrugBank	DB01750
KEGG	D01558
PubChem CID	6862
InChI InChI=1S/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)Key: PRPINYUDVPFIRX-UHFFFAOYSA-N InChI=1/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)Key: PRPINYUDVPFIRX-UHFFFAOYAF
SMILES O=C(O)Cc2cccc1ccccc12
Properties
Chemical formula	C₁₂H₁₀O₂
Molar mass	186.2066 g/mol
Appearance	White powder
Melting point	135 °C
Solubility in water	0.38 g/L (17 °C)
Acidity (pK_a)	4.24 (25 °C)
Related compounds
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):

SizeSet

Chemical compound

Naphthaleneacetic Acid (environmentalchemistry.com)
J. Chem. Soc. (1954) 4102