(9S,12R,13S,E)-9,12,13-Trihydroxyoctadec-10-enoic acid
- CAS
- 102735-58-0
- Formula
- C18H34O5
- MW
- 330.5 g/mol
ZX-041790
Carboxylic Acids & Salts
Neoabietic Acid
Available on request
Buy Neoabietic Acid (CAS 471-77-2) from Zemixal: C20H30O2, COA and SDS with every lot, worldwide shipping. Packs from 100 mg.
CAS number471-77-2
FormulaC20H30O2
Molar mass302.5 g/mol
InChIKeyKGMSWPSAVZAMKR-ONCXSQPRSA-N
IUPAC name(1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
About Neoabietic Acid
Zemixal supplies Neoabietic Acid within its pharma Intermediates & Building Blocks portfolio. Key data: CAS 471-77-2, formula C20H30O2 and molar mass 302.5 g/mol.
Where it is used
- Organic synthesis
- API synthesis
Storage and safety notes
Hazard communication follows GHS (Warning: H315, H319 and H335). Our SDS lists exposure controls and first-aid measures.
Order it in 100 mg, 250 mg, 1 g and 5 g packs or ask for a bulk quotation. Each lot travels with a batch certificate of analysis and a 16-section SDS. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.
Typical uses
- Organic synthesis
- API synthesis
Applications
Specifications and identifiers
| Product name | Neoabietic Acid |
|---|---|
| Catalogue number | ZX-041791 |
| CAS number | 471-77-2 |
| IUPAC name | (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid |
| Molecular formula | C20H30O2 |
| Molar mass | 302.5 g/mol |
| Exact mass | 302.2246 |
| XLogP3 | 5.1 |
| H-bond donors / acceptors | 1 / 2 |
| Topological polar surface area | 37.3 Ų |
| InChIKey | KGMSWPSAVZAMKR-ONCXSQPRSA-N |
| SMILES | CC(=C1CC[C@H]2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)C |
| PubChem CID | 221118 |
| Synonyms | CTCM 189, Podocarp-8(14)-en-15-oic acid, 13-isopropylidene-, CTCM-189, Neoabietate, Abieta-8(14),13(15)-dien-18-oic acid, neobietic acid, 8(14),13(15)-abietadien-18-oic acid |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
Signal word Warning
- H315Causes skin irritation
- H319Causes serious eye irritation
- H335May cause respiratory irritation
Precautionary statements P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501
Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.
Pack sizes
| 100 mg | Quoted on request | |
| 250 mg | Quoted on request | |
| 1 g | Quoted on request | |
| 5 g | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
Questions about Neoabietic Acid
Which CAS number identifies Neoabietic Acid?
Neoabietic Acid is registered under CAS 471-77-2. You may also see it listed as CTCM 189, Podocarp-8(14)-en-15-oic acid, 13-isopropylidene-, CTCM-189. Our catalogue number for this item is ZX-041791.
What are the formula and molar mass of Neoabietic Acid?
For Neoabietic Acid, its formula is C20H30O2 and its molar mass is 302.5 g/mol. The systematic (IUPAC) name is (1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid. InChIKey KGMSWPSAVZAMKR-ONCXSQPRSA-N lets you match it in any structure database.
What grade and pack sizes are available for Neoabietic Acid?
The grade and assay are confirmed on the quotation and the batch COA. Standard packs are 100 mg, 250 mg, 1 g, 5 g. Larger quantities and custom packing can be quoted on request.
Which documents come with Neoabietic Acid?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship Neoabietic Acid to my country?
Yes. Because Neoabietic Acid is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.
Related products
More in Carboxylic Acids & Salts
(9R,12R,13S,E)-9,12,13-Trihydroxyoctadec-10-enoic acid
- CAS
- 102735-59-1
- Formula
- C18H34O5
- MW
- 330.5 g/mol
ZX-041789
(9S,10S,13S,E)-9,10,13-Trihydroxyoctadec-11-enoic acid
- CAS
- 135214-44-7
- Formula
- C18H34O5
- MW
- 330.5 g/mol
ZX-041788
5,8-Dioxa-2,11-diazadodecanedioic acid, 1-(1,1-dimethylethyl) 12-(phenylmethyl) ester
- CAS
- 796865-54-8
- Formula
- C19H29N2O6-
- MW
- 381.4 g/mol
ZX-041758
Have a list of compounds to price?
Paste up to 200 CAS numbers into Bulk CAS lookup, or send one enquiry for everything in your quote list. We reply with price, lead time and documents.