N,N'-Diallyltartardiamide
Basic information
- CAS
58477-85-3- Standard SMILES
C=CCNC(=O)[C@H](O)[C@@H](O)C(=O)NCC=C- InChIKey
ZRKLEAHGBNDKHM-HTQZYQBOSA-N- Molecular formula
- C10H16N2O4
- Average molar mass
- 228.24 g/mol
- Monoisotopic mass
- 228.111007
Overview
cross linking reagent; RN given refers to (R-(R*,R*))-isomer
Names & identifiers
- Preferred name
- N,N'-Diallyltartardiamide
- IUPAC
- (2R,3R)-2,3-dihydroxy-N,N'-bis(prop-2-enyl)butanediamide
- English name
- N,N'-DIALLYL-L-TARTARDIAMIDE
- Molecular formula
- C10H16N2O4
- Molecular weight
- 228.24
Names & synonyms
58477-85-3N,N'-DiallyltartardiamideButanediamide, 2,3-dihydroxy-N1,N4-di-2-propen-1-yl-, (2R,3R)-DTXSID60886266Butanediamide, 2,3-dihydroxy-N,N'-di-2-propenyl-, (R-(R*,R*))-RefChem:160984DTXCID401025601261-277-3N,N'-Diallyl-L-tartardiamide(+)-N,N'-Diallyl-L-tartardiamidediallyltartardiamideMFCD00008640
Show more names
DATD(+)-NN'-DiallyltartramideN,N'-DIALLYLTARTRAMIDE(+)-N,N'-DIALLYLTARTRAMIDE(+)-N,N-Diallyl-L-TartramideDATD, N,Nμ-Diallyltartramide
(+)-DATDEINECS 261-277-3Butanediamide, 2,3-dihydroxy-N,N'-di-2-propenyl-, (2R,3R)-(2R,3R)-N1,N4-Diallyl-2,3-dihydroxysuccinamide(R-(R*,R*))-N,N'-Diallyltartaramide(2R,3R)-2,3-dihydroxy-N,N'-bis(prop-2-en-1-yl)butanediamideButanediamide, 2,3-dihydroxy-N,N'-di-2-propenyl-, (theta-(theta,theta))-N,N-DIALLYL-L-TARTARDIAMIDE
Database identifiers
- CAS
58477-85-3- PubChem CID
- 94074
- DTXSID
DTXSID60886266- EC Number
- 261-277-3
- Nikkaji
- J208.369H
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 250
Experimental & physicochemical properties
Chemical ClassesOther Uses -> Biochemical Research
Physical DescriptionWhite powder; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- 186 · 186-188 °C(lit.)
- Boiling point
- 370.05 °C · 370.05°C (rough estimate)
- alpha
- 108 ° · +108°(20/D) (c=2.4, H2O)
- Density
- 1.2265 · 1.2265 (rough estimate)
- refractive index
- 108 ° · 108 ° (C=2.4, H2O)
- storage temp.
- 2 · 2-8°C
- solubility
- soluble in Ethanol,Methanol
- form
- Fine Flakes
- color
- White to off-white
- optical activity
- 20 · [α]20/D +108°, c = 2.4 in H2O
- BRN
- 1712934 · 1712934
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Butanediamide, 2,3-dihydroxy-N,N'-di-2-propenyl-, [R-(R*,R*)]-
Butanediamide, 2,3-dihydroxy-N,N'-di-2-propenyl-, (2R,3R)-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29241990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
Chemistry & industry
Uses & manufacturing
UsesCross linking reagent. [ChemIDplus] A cross-linking agent in polyacrylamide gels; [Reference #1]
General Manufacturing InformationButanediamide, 2,3-dihydroxy-N1,N4-di-2-propen-1-yl-, (2R,3R)-: INACTIVE
Applications
UsesCross-linking co-monomer for the polymerization of soluble polyacrylamide gels
General Description(+)-N,N′-Diallyltartramide can be used as a cross-linking agent during the preparation of hydrogels.
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Compound notes
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