Methyl abietate (CAS 127-25-3) — formula C21H32O2, molecular weight 316.5; category organic chemicals.
| CAS Number | 127-25-3 |
|---|---|
| Molecular Formula | C21H32O2 |
| Molecular Weight | 316.5 |
| LogP | 5.1 |
| Category | Organic Chemicals |
Methyl abietate is a carbon-based organic compound with CAS registry number 127-25-3 and molecular formula C21H32O2 (molecular weight 316.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 127-25-3
Its molecular formula C21H32O2 comprises 21 C, 32 H, 2 O atoms.
Also known as: Methyl abietate · 松香酸甲酯
Category: organic chemicals
The CAS registry number of Methyl abietate is 127-25-3.
Molecular formula C21H32O2, molecular weight 316.5.
It is also registered under: Methyl abietate, 松香酸甲酯.
Category: Organic Chemicals.
Independent reference data for Methyl abietate (CAS 127-25-3), compiled from public chemistry databases.
| CAS Registry Number | 127-25-3 |
|---|---|
| PubChem CID | 173058 |
| Molecular formula | C21H32O2 |
| IUPAC name | methyl (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate |
| UNII (FDA) | BY54I7IT3L |
| Molecular Weight | 316.5 |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 316.240230259 |
| Monoisotopic Mass | 316.240230259 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 23 |
METHYL ABIETATE; 127-25-3; DTXSID9048190; BY54I7IT3L; NSC-2141; abietic acid methyl ester; DTXCID0028165; Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, methyl ester; methyl (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate; RefChem:157766; 204-832-7; Abalyn; Methyl 7,13-abietadien-18-oate; Abietic acid, methyl ester; Methyl Abietate (Technical Grade); NSC 2141
| Regulatory & Food Contact | FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS |
|---|---|
| GHS notification summary | 82.9% (248 / 299) |
| GHS notification summary | 82.9% (248 / 299) |
|---|---|
| Reported hazard statements | H319 (13.4%), H334 (13.4%) |
This chemical does not meet GHS hazard criteria for 82.9% (248 of 299) of all reports.
H319 (13.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Methyl abietate · CAS 127-25-3 · C21H32O2. UNII BY54I7IT3L.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 松香酸甲酯