N-Propargylmaleimide - CAS 209395-32-4
Catalog: |
BB057988 |
Product Name: |
N-Propargylmaleimide |
CAS: |
209395-32-4 |
Synonyms: |
1-(2-Propyn-1-yl)-1H-pyrrole-2,5-dione; 1-(2-Propynyl)-1H-pyrrole-2,5-dione; 1-(Prop-2-yn-1-yl)-1H-pyrrole-2,5-dione-N-Propargylmaleimide; 1-(Prop-2-yn-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione |
IUPAC Name: | 1-prop-2-ynylpyrrole-2,5-dione |
Description: | N-Propargylmaleimide (cas# 209395-32-4) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 135.12 |
Molecular Formula: | C7H5NO2 |
Canonical SMILES: | C#CCN1C(=O)C=CC1=O |
InChI: | InChI=1S/C7H5NO2/c1-2-5-8-6(9)3-4-7(8)10/h1,3-4H,5H2 |
InChI Key: | OBYJFWVFCFYKNY-UHFFFAOYSA-N |
References: | Parmar, S., et al. Chem. Commun., 55, 14926 (2019); Otsubo, T., et al. Chem. Lett., 48, 465 (2019). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | 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 |
Signal Word: | Warning |
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Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.032028402 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.032028402 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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