3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester (CAS 31456-93-6) — formula C19H22O6, molecular weight 346.4; category organic chemicals.
| CAS Number | 31456-93-6 |
|---|---|
| Molecular Formula | C19H22O6 |
| Molecular Weight | 346.4 |
| LogP | 2.6 |
| Category | Organic Chemicals |
3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester is a carbon-based organic compound with CAS registry number 31456-93-6 and molecular formula C19H22O6 (molecular weight 346.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 31456-93-6
Its molecular formula C19H22O6 comprises 19 C, 22 H, 6 O atoms.
Also known as: 3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester · 3-甲基丁酸(8S,9R)-8,9-二氢-8-(1-羟基-1-甲基乙基)-2-氧代-2H-呋喃并[2,3-h]-1-苯并吡喃-9-基酯
Category: organic chemicals
The CAS registry number of 3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester is 31456-93-6.
Molecular formula C19H22O6, molecular weight 346.4.
It is also registered under: 3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester, 3-甲基丁酸(8S,9R)-8,9-二氢-8-(1-羟基-1-甲基乙基)-2-氧代-2H-呋喃并[2,3-h]-1-苯并吡喃-9-基酯.
Category: Organic Chemicals.
Independent reference data for 3-Methylbutanoic acid (8S,9R)-8,9-dihydro-8-(1-hydroxy-1-methylethyl)-2-oxo-2H-furo[2,3-h]-1-benzopyran-9-yl ester (CAS 31456-93-6), compiled from public chemistry databases.
| CAS 号 | 31456-93-6 |
|---|---|
| PubChem CID | 12299857 |
| 分子式 | C19H22O6 |
| IUPAC 名称 | [(8S,9R)-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate |
| Molecular Weight | 346.4 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 346.14163842 |
| Monoisotopic Mass | 346.14163842 |
| Topological Polar Surface Area | 82.1 |
| Heavy Atom Count | 25 |
Vaginidin; 31456-93-6; XV163806; [(8S,9R)-8-(2-hydroxypropan-2-yl)-2-oxo-8,9-dihydrofuro[2,3-h]chromen-9-yl] 3-methylbutanoate
3-甲基丁酸(8S,9R)-8,9-二氢-8-(1-羟基-1-甲基乙基)-2-氧代-2H-呋喃并[2,3-h]-1-苯并吡喃-9-基酯 · CAS 31456-93-6 · C19H22O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-甲基丁酸(8S,9R)-8,9-二氢-8-(1-羟基-1-甲基乙基)-2-氧代-2H-呋喃并[2,3-h]-1-苯并吡喃-9-基酯