5-Isocyanato-2,3-dihydrobenzofuran - CAS 215162-92-8
Catalog: |
BB016932 |
Product Name: |
5-Isocyanato-2,3-dihydrobenzofuran |
CAS: |
215162-92-8 |
Synonyms: |
5-isocyanato-2,3-dihydrobenzofuran; 5-isocyanato-2,3-dihydro-1-benzofuran |
IUPAC Name: | 5-isocyanato-2,3-dihydro-1-benzofuran |
Description: | 5-Isocyanato-2,3-dihydrobenzofuran (CAS# 215162-92-8) is a useful research chemical. |
Molecular Weight: | 161.16 |
Molecular Formula: | C9H7NO2 |
Canonical SMILES: | C1COC2=C1C=C(C=C2)N=C=O |
InChI: | InChI=1S/C9H7NO2/c11-6-10-8-1-2-9-7(5-8)3-4-12-9/h1-2,5H,3-4H2 |
InChI Key: | WAIKTAFMGLVRJC-UHFFFAOYSA-N |
Boiling Point: | 130-132 °C / 3 mmHg |
Density: | 1.25 g/cm3 |
Appearance: | Solid |
LogP: | 1.58880 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H311 (100%): Toxic in contact with skin [Danger Acute toxicity, dermal] |
Precautionary Statement: | P264, P270, P280, P301+P316, P302+P352, P316, P321, P330, P361+P364, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021004842-A1 | Polymerizable compositions for preparing polyisocyanurate-based plastics having extended worklife | 20190708 |
TW-202003448-A | Adducts of amine catalysts for producing isocyanurate polymers | 20180413 |
WO-2019197638-A1 | Adducts of amine catalysts for producing isocyanurate polymers | 20180413 |
CN-112020525-A | Adducts of amine catalysts for making isocyanurate polymers | 20180413 |
EP-3774961-A1 | Adducts of amine catalysts for producing isocyanurate polymers | 20180413 |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.047678466 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.047678466 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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