3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one (CAS 85391-01-1) — formula C28H28O5, molecular weight 444.5; category organic chemicals.
| CAS Number | 85391-01-1 |
|---|---|
| Molecular Formula | C28H28O5 |
| Molecular Weight | 444.5 |
| LogP | 6.6 |
| Category | Organic Chemicals |
3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one is a carbon-based organic compound with CAS registry number 85391-01-1 and molecular formula C28H28O5 (molecular weight 444.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85391-01-1
Its molecular formula C28H28O5 comprises 28 C, 28 H, 5 O atoms.
Also known as: 3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one · 3',6'-二丁氧基螺[异苯并呋喃-1(3H),9'-[9H]呫吨]-3-酮
Category: organic chemicals
The CAS registry number of 3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one is 85391-01-1.
Molecular formula C28H28O5, molecular weight 444.5.
It is also registered under: 3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one, 3',6'-二丁氧基螺[异苯并呋喃-1(3H),9'-[9H]呫吨]-3-酮.
Category: Organic Chemicals.
Independent reference data for 3',6'-dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one (CAS 85391-01-1), compiled from public chemistry databases.
| CAS 号 | 85391-01-1 |
|---|---|
| PubChem CID | 14323645 |
| 分子式 | C28H28O5 |
| IUPAC 名称 | 3',6'-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one |
| UNII（FDA） | 3QTE5379ZN |
| Molecular Weight | 444.5 |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 444.19367399 |
| Monoisotopic Mass | 444.19367399 |
| Topological Polar Surface Area | 54 |
| Heavy Atom Count | 33 |
85391-01-1; 3',6'-Dibutoxyspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one; 3QTE5379ZN; 3',6'-dibutoxy-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one; EINECS 286-753-8; UNII-3QTE5379ZN; 3',6'-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one; DTXSID50234555; NISVSXJMPPNUMP-UHFFFAOYSA-N; NS00038889; 3',6'-Dibutoxy-3H-spiro[[2]benzofuran-1,9'-xanthen]-3-one; 3',6'-Dibutoxyspiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one; Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 3',6'-dibutoxy-
3',6'-二丁氧基螺[异苯并呋喃-1(3H),9'-[9H]呫吨]-3-酮 · CAS 85391-01-1 · C28H28O5. UNII 3QTE5379ZN.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.