2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)- (CAS 84272-84-4) — formula C20H22O6, molecular weight 358.4; category organic chemicals.
| CAS Number | 84272-84-4 |
|---|---|
| Molecular Formula | C20H22O6 |
| Molecular Weight | 358.4 |
| LogP | 3.9 |
| Category | Organic Chemicals |
2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)- is a carbon-based organic compound with CAS registry number 84272-84-4 and molecular formula C20H22O6 (molecular weight 358.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 84272-84-4
Its molecular formula C20H22O6 comprises 20 C, 22 H, 6 O atoms.
Also known as: 2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)- · 3'-O-当归酰基亥茅酚
Category: organic chemicals
The CAS registry number of 2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)- is 84272-84-4.
Molecular formula C20H22O6, molecular weight 358.4.
It is also registered under: 2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)-, 3'-O-当归酰基亥茅酚.
Category: Organic Chemicals.
Independent reference data for 2-Butenoic acid, 2-methyl-, (3S)-3,4-dihydro-5-hydroxy-2,2,8-trimethyl-6-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-3-yl ester, (2Z)- (CAS 84272-84-4), compiled from public chemistry databases.
| CAS 号 | 84272-84-4 |
|---|---|
| PubChem CID | 56643444 |
| 分子式 | C20H22O6 |
| IUPAC 名称 | [(3S)-5-hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydropyrano[3,2-g]chromen-3-yl] (Z)-2-methylbut-2-enoate |
| Molecular Weight | 358.4 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 358.14163842 |
| Monoisotopic Mass | 358.14163842 |
| Topological Polar Surface Area | 82.1 |
| Heavy Atom Count | 26 |
((3S)-5-hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydropyrano(3,2-g)chromen-3-yl) (Z)-2-methylbut-2-enoate; [(3S)-5-hydroxy-2,2,8-trimethyl-6-oxo-3,4-dihydropyrano[3,2-g]chromen-3-yl] (Z)-2-methylbut-2-enoate; 3-O-Angeloylhamaudol; RefChem:1068367; 3'-O-Angeloylhamaudol; 84272-84-4; 3 inverted exclamation marka-O-Angeloylhamaudol; 3'-O-angeloyhamaudol; 3a?O-Angeloylhamaudol; orb1941406; orb1992471; CHEMBL2059289; HY-N10609; AKOS040734257; FS-7333; DA-69931
3'-O-当归酰基亥茅酚 · CAS 84272-84-4 · C20H22O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3'-O-当归酰基亥茅酚