NEOABIETIC ACID
TL;DR: NEOABIETIC ACID (CAS 471-77-2) is a chemical compound with molecular formula C20H30O2 and molecular weight 302.22458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
新松香酸
1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Also Known As: NEOABIETIC ACID, CYCLOHEPTANONE, CTCM 189, Abieta-8(14),13(15)-dien-18-oic acid, Podocarp-8(14)-en-15-oic acid, 13-isopropylidene-
Technical Specifications
| Molecular Formula | C20H30O2 |
| Molecular Weight | 302.22458 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.22458 Da |
| Heavy Atoms | 22 |
| Complexity | 552.0 |
| SMILES | CC(=C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C |
| InChIKey | KGMSWPSAVZAMKR-UHFFFAOYSA-N |
Product Description
Applications: NEOABIETIC ACID is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
NEOABIETIC ACID is a fine chemical identified by CAS number 471-77-2 and the molecular formula C20H30O2 and a molecular weight of 302.22 g/mol. Synonyms include NEOABIETIC ACID and CYCLOHEPTANONE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of NEOABIETIC ACID
Property Insights of NEOABIETIC ACID
The XLogP value of 5.1 indicates that NEOABIETIC ACID is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, NEOABIETIC ACID exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NEOABIETIC ACID has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of NEOABIETIC ACID?
The CAS number of NEOABIETIC ACID is 471-77-2.
What is the molecular formula of NEOABIETIC ACID?
The molecular formula of NEOABIETIC ACID is C20H30O2.
What is the molecular weight of NEOABIETIC ACID?
The molecular weight of NEOABIETIC ACID is 302.22458 g/mol.
What are the applications of NEOABIETIC ACID?
NEOABIETIC ACID is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy NEOABIETIC ACID?
You can request a quote for NEOABIETIC ACID directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for NEOABIETIC ACID?
Yes, CoreyChem provides custom synthesis services for NEOABIETIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.