Triptoquinonea

Catalog Number

ACM142950865

Product Name

Triptoquinonea

Structure

CAS

142950-86-5

Category

Heterocyclic Organic Compound

Synonyms

Triptoquinone A, AC1L3154, (4aS,10aS)-1,4a-dimethyl-5,8-dioxo-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-2-carboxylic acid, (4aS-trans)-3,4,4a,5,8,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-5,8-dioxo-2-phenanthrenecarboxylic acid, 142950-86-5, 2-Phenanthrenecarboxylic acid, 3,4,4a,5,8,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-5,8-dioxo-, (4aS-trans)-

IUPAC Name

(4aS,10aS)-1,4a-dimethyl-5,8-dioxo-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene-2-carboxylic acid

Molecular Weight

328.402160 [g/mol]

Molecular Formula

C20H24O4

Canonical SMILES

CC1=C(CCC2(C1CCC3=C2C(=O)C=C(C3=O)C(C)C)C)C(=O)O

InChI Key

PDPFWAJAYGLYHD-YWZLYKJASA-N

Boiling Point

489.6ºC at 760mmHg

Flash Point

264ºC

Density

1.21g/cm³

Exact Mass

328.16700

H-Bond Acceptor

4

H-Bond Donor

1

MSDS

COA

Spec Sheet