Dehydroabietic Acid

• Catalog Number: ACM1740198
• Product Name: Dehydroabietic Acid
• CAS: 1740-19-8
• Category: Heterocyclic Organic Compound
• Synonyms: [1theta-(1alpha,4abeta,10aalpha)]--methylethyl);13-isopropylpodocarpa-8,11,13-trien-15-oicacid;13-trien-15-oicacid,13-isopropyl-podocarpa-11;1-phenanthrenecarboxylicacid,1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1;dehydro-abieticaci;DEHYDROABIETIC ACID;[1R-(1alpha,4abeta,10aalpha)]-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylic acid ;PODOCARPA-8,11,13-TRIEN-15-OICACID,13-ISOPROPYL-
• IUPAC Name: (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
• Molecular Weight: 300.4
• Molecular Formula: C20H28O2
• Canonical SMILES: CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C
• InChI: InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17-,19-,20-/m1/s1
• InChI Key: NFWKVWVWBFBAOV-MISYRCLQSA-N
• Melting Point: 174-176°C
• Density: 1.058
• Appearance: Powder
• Hazard Statements: T,N
• Safety Description: 45-61
• Supplemental Hazard Statements: H301-H410
• Symbol: GHS06,GHS09

Custom Q&A

What is the molecular formula of dehydroabietic acid?

The molecular formula of dehydroabietic acid is C20H28O2.

What is the molecular weight of dehydroabietic acid?

The molecular weight of dehydroabietic acid is 300.4 g/mol.

What is the IUPAC name of dehydroabietic acid?

The IUPAC name of dehydroabietic acid is (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid.

What are the synonyms of dehydroabietic acid?

The synonyms of dehydroabietic acid include DEHYDROABIETIC ACID, Dehydroabietate, Abieta-8,11,13-trien-18-oic acid, and Abietic acid, dehydro.

In which organisms is dehydroabietic acid found?

Dehydroabietic acid is found in Nostoc, Relhania corymbosa, and other organisms with available data.

What is the InChIKey of dehydroabietic acid?

The InChIKey of dehydroabietic acid is NFWKVWVWBFBAOV-MISYRCLQSA-N.

What is the CAS number of dehydroabietic acid?

The CAS number of dehydroabietic acid is 1740-19-8.

What is the ChEMBL ID of dehydroabietic acid?

The ChEMBL ID of dehydroabietic acid is CHEMBL12850.

How many hydrogen bond donor counts does dehydroabietic acid have?

Dehydroabietic acid has a hydrogen bond donor count of 1.

What is the XLogP3-AA value of dehydroabietic acid?

The XLogP3-AA value of dehydroabietic acid is 5.6.