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

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Revision as of 14:11, 21 November 2011 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{drugbox}} taken from revid 456660125 of page Hexafluronium_bromide for the Chem/Drugbox validation project (updated: 'UNII', 'CAS_number').← Previous edit		Revision as of 14:14, 21 November 2011 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,084 edits Saving copy of the {{chembox}} taken from revid 444432840 of page Hexamethylphosphoramide for the Chem/Drugbox validation project (updated: 'KEGG').Next edit →
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	{{ambox \| text = This page contains a copy of the infobox ({{tl\|~~drugbox~~}}) 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.}}
	{{~~Drugbox~~		{{chembox
	\| Verifiedfields = changed		\| Verifiedfields = changed
	\| Watchedfields = changed		\| Watchedfields = changed
	\| verifiedrevid = ~~400104397~~		\| verifiedrevid = 400104650
			\| Name = Hexamethylphosphoramide
	\| IUPAC_name = ''N,N'''-di-9''H''-fluoren-9-yl-''N'',''N'',''N<nowiki>'</nowiki>'',''N<nowiki>'</nowiki>''-tetramethylhexane-1,6-diaminium dibromide
			\| ImageFile = HMPA-2D-skeletal.png
	\| image = Hexafluronium bromide.svg
			\| ImageName = Chemical structure of HMPA
	\| width = 250px
			\| ImageFile1 = Hexamethylphosphoramide-from-xtal-3D-balls.png
	\| drug_name = Hexafluronium
			\| ImageName1 = 3D stick model of HMPA

			\| PIN=Hexamethylphosphoric triamide
	<!--Clinical data-->
			\| IUPACName = Hexamethylphosphoramide
	\| tradename =
			\| OtherNames = Hexametapol<br /> HMPA
	\| pregnancy_category =
			\| Section1 = {{Chembox Identifiers
	\| legal_status =
		⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| routes_of_administration =
		⚫	\| ChemSpiderID = 12158

		⚫	\| PubChem = 12679
	<!--Pharmacokinetic data-->
			\| InChI = 1/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3
	\| bioavailability =
			\| InChIKey = GNOIPBMMFNIUFM-UHFFFAOYAP
	\| protein_bound =
	\| metabolism =
	\| elimination_half-life =
	\| excretion =

	<!--Identifiers-->
⚫	\| ~~CAS_number_Ref~~ = {{cascite\|correct\|??}}
⚫	\| ~~CAS_number~~ = <!-- blanked - oldvalue: ~~4844-10-4~~ -->
	\| ATC_prefix = M03
	\| ATC_suffix = AC05
⚫	\| PubChem = ~~9434~~
	\| DrugBank_Ref = {{drugbankcite\|changed\|drugbank}}
	\| DrugBank = DB00941
⚫	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
⚫	\| ChemSpiderID = ~~9063~~
⚫	\| ~~UNII_Ref~~ = {{~~fdacite~~\|changed\|~~FDA~~}}
	\| UNII = <!-- blanked - oldvalue: B64NJG83K2 -->
⚫	\| ~~KEGG_Ref~~ = {{~~keggcite~~\|changed\|~~kegg~~}}
	\| KEGG = D04435

	<!--Chemical data-->
⚫	\| C=36 \| H=42 \| Br=2 \| N=2
	\| molecular_weight = 662.54 g/mol
	\| smiles = ..c1cccc3c1c2c(cccc2)C3(CCCCCC(C6c4ccccc4c5ccccc56)(C)C)(C)C
	\| InChI = 1/C36H42N2.2BrH/c1-37(2,35-31-21-11-7-17-27(31)28-18-8-12-22-32(28)35)25-15-5-6-16-26-38(3,4)36-33-23-13-9-19-29(33)30-20-10-14-24-34(30)36;;/h7-14,17-24,35-36H,5-6,15-16,25-26H2,1-4H3;2*1H/q+2;;/p-2
	\| InChIKey = WDEFPRUEZRUYNW-NUQVWONBAQ
	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
			\| StdInChI = 1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3
	\| StdInChI = 1S/C36H42N2.2BrH/c1-37(2,35-31-21-11-7-17-27(31)28-18-8-12-22-32(28)35)25-15-5-6-16-26-38(3,4)36-33-23-13-9-19-29(33)30-20-10-14-24-34(30)36;;/h7-14,17-24,35-36H,5-6,15-16,25-26H2,1-4H3;2*1H/q+2;;/p-2
	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}		\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChIKey = ~~WDEFPRUEZRUYNW~~-UHFFFAOYSA-L		\| StdInChIKey = GNOIPBMMFNIUFM-UHFFFAOYSA-N
		⚫	\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| CASNo = 680-31-9
		⚫	\| KEGG_Ref = {{keggcite\|changed\|kegg}}
		⚫	\| KEGG = <!-- blanked - oldvalue: C19250 -->
		⚫	\| ChEBI_Ref = {{ebicite\|changed\|EBI}}
			\| ChEBI = 24565
			\| SMILES = O=P(N(C)C)(N(C)C)N(C)C
			}}
			\| Section2 = {{Chembox Properties
		⚫	\| C = 6 \| H = 18 \| N = 3 \| O = 1 \| P = 1
			\| MolarMass = 179.20 g/mol
			\| Density = 1.03 g/cm<sup>3</sup>
			\| MeltingPtC = 7.20
			\| BoilingPtC = 232.5
			\| Boiling_notes = CRC<ref>{{CRC91\|page=3-280}}</ref>
			}}
			\| Section7 = {{Chembox Hazards
			\| ExternalMSDS =
			\| EUClass = {{Hazchem Xn}}
			}}
	}}		}}

Revision as of 14:14, 21 November 2011

This page contains a copy of the infobox ({{chembox}}) taken from revid 444432840 of page Hexamethylphosphoramide with values updated to verified values.

Hexamethylphosphoramide
Names
Chemical structure of HMPA
3D stick model of HMPA
IUPAC name Hexamethylphosphoramide
Preferred IUPAC name Hexamethylphosphoric triamide
Other names Hexametapol HMPA
Identifiers
CAS Number	680-31-9
3D model (JSmol)	Interactive image
ChEBI	CHEBI:24565
ChemSpider	12158
PubChem CID	12679
InChI InChI=1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3Key: GNOIPBMMFNIUFM-UHFFFAOYSA-N InChI=1/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3Key: GNOIPBMMFNIUFM-UHFFFAOYAP
SMILES O=P(N(C)C)(N(C)C)N(C)C
Properties
Chemical formula	C₆H₁₈N₃OP
Molar mass	179.20 g/mol
Density	1.03 g/cm
Melting point	7.20 °C (44.96 °F; 280.35 K)
Boiling point	232.5 °C (450.5 °F; 505.6 K)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). N verify (what is ?) Infobox references

Chemical compound

Haynes, William M. (2010). Handbook of Chemistry and Physics (91 ed.). Boca Raton, Florida, USA: CRC Press. p. 3-280. ISBN 978-1-43982077-3.