Methacryloyloxyethyl isocyanate

C₇H₉NO₃CAS 30674-80-7155.15 g/mol

Open in Covalent MOL file

Alkene Ester Isocyanate

Properties

Molecular formula: C₇H₉NO₃
Molar mass: 155.15 g/mol
Exact mass: 155.0582 Da
Boiling point: 87–89 °C (at 10 Torr)
logP: 0.44Crippen estimate
Polar surface area: 55.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 4

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation88.7% of notifiers
H317 May cause an allergic skin reaction96.2% of notifiers
H318 Causes serious eye damage15.1% of notifiers
H319 Causes serious eye irritation73.6% of notifiers
H330 Fatal if inhaled98.1% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled98.1% of notifiers
H335 May cause respiratory irritation77.4% of notifiers

Aggregated from 53 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, P501

Identifiers

CAS number

30674-80-7

SMILES

C=C(C)C(=O)OCCN=C=O

InChIKey

RBQRWNWVPQDTJJ-UHFFFAOYSA-N

InChI

InChI=1S/C7H9NO3/c1-6(2)7(10)11-4-3-8-5-9/h1,3-4H2,2H3

Weigh it out

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

Names and synonyms

12 names

2-Propenoic acid, 2-methyl-, 2-isocyanatoethyl ester
Methacrylic acid, 2-isocyanatoethyl ester
Isocyanic acid, 2-hydroxyethyl ester methacrylate (ester)
Methacrylic acid β-isocyanatoethyl ester
β-Isocyanatoethyl methacrylate
2-Isocyanatoethyl methacrylate
Karenz MOI
2-(Methacryloyloxy)ethyl isocyanate
2-(Methacryloxy)ethyl isocyanate
2-Isocyanatoethyl 2-methylacrylate
2-Isocyanatoethyl 2-methyl-2-propenoate
Aldrich 477060

Work with Methacryloyloxyethyl isocyanate

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

Polyethylene glycol dimethacrylate25852-47-563 % similar Ethylene glycol dimethacrylate97-90-563 % similar Butanediol dimethacrylate2082-81-759 % similar Hexamethylene dimethacrylate6606-59-359 % similar 12-(2-Methylprop-2-enoyloxy)dodecyl 2-methylprop-2-enoate72829-09-559 % similar Triethylene glycol dimethacrylate109-16-058 % similar Tetraethylene glycol dimethacrylate109-17-158 % similar Diethylene glycol bis(methacrylate)2358-84-158 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

D-2-Furylalanine110772-46-8 3-Furan-2-ylalanine127682-08-0 Ethyl 5-methylisoxazole-3-carboxylate3209-72-1 Ethyl 5-methylisoxazole-4-carboxylate51135-73-0 Ammonium salicylate528-94-9 3-Amino-3-(furan-2-yl)propanoic acid73456-99-2

Elsewhere

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