3-CYANO-7-ETHOXYCOUMARIN (CAS 117620-77-6) — formula C12H9NO3, molecular weight 215.20; category organic chemicals.
| CAS Number | 117620-77-6 |
|---|---|
| Molecular Formula | C12H9NO3 |
| Molecular Weight | 215.20 |
| LogP | 2.2 |
| Category | Organic Chemicals |
3-CYANO-7-ETHOXYCOUMARIN is a carbon-based organic compound with CAS registry number 117620-77-6 and molecular formula C12H9NO3 (molecular weight 215.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 117620-77-6
Its molecular formula C12H9NO3 comprises 12 C, 9 H, 1 N, 3 O atoms.
Also known as: 3-CYANO-7-ETHOXYCOUMARIN · 3-氰基-7-乙氧基香豆素
Category: organic chemicals
The CAS registry number of 3-CYANO-7-ETHOXYCOUMARIN is 117620-77-6.
Molecular formula C12H9NO3, molecular weight 215.20.
It is also registered under: 3-CYANO-7-ETHOXYCOUMARIN, 3-氰基-7-乙氧基香豆素.
Category: Organic Chemicals.
Independent reference data for 3-CYANO-7-ETHOXYCOUMARIN (CAS 117620-77-6), compiled from public chemistry databases.
| CAS Registry Number | 117620-77-6 |
|---|---|
| PubChem CID | 164045 |
| Molecular formula | C12H9NO3 |
| IUPAC name | 7-ethoxy-2-oxochromene-3-carbonitrile |
| UNII (FDA) | 997LV3DUS7 |
| Molecular Weight | 215.20 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 215.058243149 |
| Monoisotopic Mass | 215.058243149 |
| Topological Polar Surface Area | 59.3 |
| Heavy Atom Count | 16 |
3-Cyano-7-ethoxycoumarin; 117620-77-6; 3-Cetc; 7-ethoxy-2-oxochromene-3-carbonitrile; 2H-1-Benzopyran-3-carbonitrile, 7-ethoxy-2-oxo-; DTXSID00151844; 997LV3DUS7; RefChem:93566; DTXCID1074335; 621-103-2; 7-ethoxy-2-oxo-2h-chromene-3-carbonitrile; 7-Ethoxycoumarin-3-carbonitrile; 7-Ethoxy-2-oxo-2H-1-benzopyran-3-carbonitrile; MFCD00467359; US9173935, CEC; F17419
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
3-CYANO-7-ETHOXYCOUMARIN · CAS 117620-77-6 · C12H9NO3. UNII 997LV3DUS7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氰基-7-乙氧基香豆素