1,1′,1′′-(1,3,5-Triazine-1,3,5(2H,4H,6H)-triyl)tris[2-propen-1-one]

C₁₂H₁₅N₃O₃CAS 959-52-4249.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₅N₃O₃
Molar mass: 249.27 g/mol
Exact mass: 249.1113 Da
Melting point: 158 °C
logP: -0.08Crippen estimate
Polar surface area: 60.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 3

Hazards

Danger

H310 Fatal in contact with skin95.3% of notifiers
H314 Causes severe skin burns and eye damage90.7% of notifiers
H317 May cause an allergic skin reaction100% of notifiers
H318 Causes serious eye damage11.6% of notifiers
H331 Toxic if inhaled90.7% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P262, P264, P264+P265, P270, P271, P272, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P333+P317, P342+P316, P361+P364, P362+P364, P363, P403, P403+P233, P405, P501

Identifiers

CAS number

959-52-4

SMILES

C=CC(=O)N1CN(C(=O)C=C)CN(C(=O)C=C)C1

InChIKey

FYBFGAFWCBMEDG-UHFFFAOYSA-N

InChI

InChI=1S/C12H15N3O3/c1-4-10(16)13-7-14(11(17)5-2)9-15(8-13)12(18)6-3/h4-6H,1-3,7-9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

30 names · show all

2-Propen-1-one, 1,1′,1′′-(1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris-
s-Triazine, 1,3,5-triacryloylhexahydro-
1,3,5-Triazine, hexahydro-1,3,5-tris(1-oxo-2-propenyl)-
Triacrylformal
Hexahydro-1,3,5-triacryloyl-s-triazine
1,3,5-Triacryloyltrimethylenetriamine
Fixierer P
Triacryloylhexahydrotriazine
Tris(acryloyl)hexahydro-s-triazine
1,3,5-Triacryloylhexahydro-s-triazine
Triacryloylperhydrotriazine
Tri(N-acryloyl)hexahydrotriazine
1,3,5-Triacryloylhexahydro-1,3,5-triazine
1,3,5-Triacryloyl-s-triazine
1,3,5-Triacryloylhexahydrotriazine
1,3,5-Tris(acryloyl)hexahydro-s-triazine
Tris(N-acryloyl)hexahydrotriazine
Triacryloylhexahydro-s-triazine
Hexahydrotris(acryloyl)-s-triazine
DU 801
Fixing agent P
TAF
TAF (crosslinking agent)
1,3,5-Triacryloylaminohexahydro-s-triazine
NSC 63839
NSC 8185
1-[3,5-Di(prop-2-enoyl)-1,3,5-triazinan-1-yl]prop-2-en-1-one
1: PN: WO2020148529 PAGE: 32 claimed sequence
TAT
Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine

Work with 1,1′,1′′-(1,3,5-Triazine-1,3,5(2H,4H,6H)-triyl)tris[2-propen-1-one]

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,4-Bis(acryloyl)piperazine6342-17-271 % similar Acryloylmorpholine5117-12-458 % similar N,N-Dimethylacrylamide2680-03-750 % similar 1-Penten-3-one1629-58-933 % similar Ethylene glycol diacrylate26570-48-933 % similar N,N'-Ethylenebisacrylamide2956-58-333 % similar N-Succinimidyl acrylate38862-24-732 % similar Acrylic anhydride2051-76-532 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Triallyl cyanurate101-37-1 Triallyl isocyanurate1025-15-6 Oxibendazole20559-55-1

Elsewhere

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