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Revision as of 16:08, 16 February 2012 editBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 476512672 of page 1,2-Bis(diphenylphosphino)ethane for the Chem/Drugbox validation project (updated: '').← Previous edit		Revision as of 16:08, 16 February 2012 edit undoBeetstra (talk \| contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 465877166 of page 1,2-Butanediol 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
		⚫	\| verifiedrevid = 443340093
	\| Verifiedfields = changed
			\| Name = 1,2-Butanediol
⚫	\| verifiedrevid = ~~456360220~~
		⚫	\| ImageFile = 1,2-Butanediol.png
	\| Name = 1,2-Bis(diphenylphosphino)ethane
			\| ImageName = Molecular forula of 1,2-Butanediol
⚫	\| ImageFile = ~~DPPE structure~~.~~svg~~
	~~<!--~~ \| ~~ImageSize~~ = ~~200px~~ -->		\| IUPACName = Butane-1,2-diol
			\| OtherNames = 1,2-Dihydroxybutane<br/>α-Butylene glycol
	\| ImageName =
	\| ImageFile1 = Dppe-from-xtal-2001-3D-balls.png
	<!-- \| ImageSize1 = 200px -->
	\| ImageName1 = dppe
	\| IUPACName = Ethane-1,2-diylbis(diphenylphosphane)
	\| OtherNames = 1,2-Bis(diphenylphosphino)ethane<br />Diphos<br />Dppe
	\| Section1 = {{Chembox Identifiers		\| Section1 = {{Chembox Identifiers
			\| InChI = 1/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3
		⚫	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
			\| StdInChI = 1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3
			\| InChIKey = BMRWNKZVCUKKSR-UHFFFAOYAV
		⚫	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
		⚫	\| StdInChIKey = BMRWNKZVCUKKSR-UHFFFAOYSA-N
		⚫	\| UNII_Ref = {{fdacite\|correct\|FDA}}
			\| UNII = RUN0H01QEU
			\| SMILES = OCC(O)CC
			\| SMILES1 = CCC(CO)O
		⚫	\| CASNo = 584-03-2
			\| CASNo_Ref = {{cascite\|correct\|CAS}}
			\| EC-number = 209-527-2
	\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}		\| ChemSpiderID_Ref = {{chemspidercite\|correct\|chemspider}}
	\| ChEBI_Ref = {{ebicite\|correct\|EBI}}		\| ChEBI_Ref = {{ebicite\|correct\|EBI}}
	\| ChEBI = ~~30669~~		\| ChEBI = 52682
	\| ChemSpiderID = ~~66873~~		\| ChemSpiderID = 10948
			\| RTECS = EK0380000
	\| InChI = 1/C26H24P2/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
	\| SMILES = P(c1ccccc1)(c2ccccc2)CCP(c3ccccc3)c4ccccc4
	\| InChIKey = QFMZQPDHXULLKC-UHFFFAOYAX
	\| SMILES1 = c1ccc(cc1)P(CCP(c2ccccc2)c3ccccc3)c4ccccc4
	\| ChEMBL_Ref = {{ebicite\|changed\|EBI}}
	\| ChEMBL = 68683
⚫	\| StdInChI_Ref = {{stdinchicite\|correct\|chemspider}}
	\| StdInChI = 1S/C26H24P2/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
⚫	\| StdInChIKey_Ref = {{stdinchicite\|correct\|chemspider}}
⚫	\| StdInChIKey = ~~QFMZQPDHXULLKC~~-UHFFFAOYSA-N
⚫	\| ~~CASNo_Ref~~ = {{~~cascite~~\|correct\|~~CAS~~}}
⚫	\| CASNo = ~~1663~~-45-2
	}}		}}
	\| Section2 = {{Chembox Properties		\| Section2 = {{Chembox Properties
			\| Reference = <ref>{{RubberBible62nd\|page=C-190}}.</ref><ref>{{Ullmann \| volume = A1 \| page = VA4 461}}.</ref><ref name="SIDS">{{SIDS-ref\|id=584032\|name=1,2-Butanediol\|date=February 1995}}.</ref>
	\| Formula = C<sub>26</sub>H<sub>24</sub>P<sub>2		\| Formula = C<sub>4</sub>H<sub>10</sub>O<sub>2</sub>
⚫	\| ~~MolarMass~~ = ~~398~~.42 g/mol
	\| ~~MeltingPt~~ = ~~140-142~~ °C		\| MolarMass = 90.121 g/mol
			\| Density = 1.0023 g/cm<sup>3</sup> (20 °C)
			\| MeltingPt = −50 °C<ref group="note">The value of −50 °C for the melting point is taken from ''Ullmann's Encyclopedia of Industrial Chemistry'' and used by the ] and the OECD ]. Other reported values of the melting point range from −114 °C to −30 °C.</ref>
			\| BoilingPt = 195–196.9 °C<br/>96.5 °C (10 mmHg)
			\| Solubility = miscible
			\| SolubleOther = soluble in ], ]; sparingly soluble in ]s and ]s; insoluble in ]s
			\| RefractIndex = 1.4378 (20 °C)
			\| Viscosity = 7.3 mPa s (20 °C)
			}}
			\| Section3 = {{Chembox Thermochemistry
			\| Reference = <ref>{{citation \| last1 = Moureu \| first1 = H. \| last2 = Dode \| first2 = M. \| title = Chaleurs de formation de l'oxyde d'ethylene, de l'ethanediol et de quelques homologues \| journal = Bull. Soc. Chim. Fr. \| year = 1937 \| volume = 4 \| pages = 637–47}}.</ref>
		⚫	\| DeltaHf = −532.8 kJ/mol
			\| DeltaHc = −2479 kJ/mol
			}}
			\| Section7 = {{Chembox Hazards
			\| Reference = <ref name="ICSC">{{ICSC-ref\|03\|95\|name=1,2-Butanediol\|date=March 1996}}.</ref>
			\| ExternalMSDS =
			\| EUIndex = not listed
			\| FlashPt = 90 °C
			}}
			\| Section8 = {{Chembox Related
			\| OtherFunctn = ]<br/>]<br/>]
			\| Function = ]s
			\| OtherCpds = ]<br/>]<br/>]<br/>]<br/>]
	}}		}}
	}}		}}

Revision as of 16:08, 16 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 465877166 of page 1,2-Butanediol with values updated to verified values.

1,2-Butanediol
Names

IUPAC name Butane-1,2-diol
Other names 1,2-Dihydroxybutane α-Butylene glycol
Identifiers
CAS Number	584-03-2
3D model (JSmol)	Interactive image Interactive image
ChEBI	CHEBI:52682
ChemSpider	10948
RTECS number	EK0380000
UNII	RUN0H01QEU
InChI InChI=1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3Key: BMRWNKZVCUKKSR-UHFFFAOYSA-N InChI=1/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3Key: BMRWNKZVCUKKSR-UHFFFAOYAV
SMILES OCC(O)CC CCC(CO)O
Properties
Chemical formula	C₄H₁₀O₂
Molar mass	90.121 g/mol
Density	1.0023 g/cm (20 °C)
Melting point	−50 °C
Boiling point	195–196.9 °C 96.5 °C (10 mmHg)
Solubility in water	miscible
Solubility	soluble in ethanol, acetone; sparingly soluble in esters and ethers; insoluble in hydrocarbons
Refractive index (n_D)	1.4378 (20 °C)
Viscosity	7.3 mPa s (20 °C)
Thermochemistry
Std enthalpy of formation (Δ_fH₂₉₈)	−532.8 kJ/mol
Std enthalpy of combustion (Δ_cH₂₉₈)	−2479 kJ/mol
Hazards
Flash point	90 °C
Related compounds
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

Cite error: There are <ref group=note> tags on this page, but the references will not show without a {{reflist|group=note}} template (see the help page).

Weast, Robert C., ed. (1981). CRC Handbook of Chemistry and Physics (62nd ed.). Boca Raton, Florida: CRC Press. p. C-190. ISBN 0-8493-0462-8..
Ullmann's Encyclopedia of Industrial Chemistry. Vol. A1. Weinheim: Wiley-VCH. p. VA4 461. ISBN 978-3527306732..
1,2-Butanediol (PDF), SIDS Initial Assessment Report, Geneva: United Nations Environment Programme, February 1995.
Moureu, H.; Dode, M. (1937), "Chaleurs de formation de l'oxyde d'ethylene, de l'ethanediol et de quelques homologues", Bull. Soc. Chim. Fr., 4: 637–47.
1,2-Butanediol, International Chemical Safety Card 0395, Geneva: International Programme on Chemical Safety, March 1996.