(3Z)-8-hydroxy-3-(hydroxymethylidene)-10a,12a-dimethyl-4a,4b,5,6,6a,7,8,9,10,10b,11,12-dodecahydro-4H-naphtho[2,1-f]chromen-2-one

Base Information

• Chemical Name: (3Z)-8-hydroxy-3-(hydroxymethylidene)-10a,12a-dimethyl-4a,4b,5,6,6a,7,8,9,10,10b,11,12-dodecahydro-4H-naphtho[2,1-f]chromen-2-one
• CAS No.: 16989-97-2
• Molecular Weight: 0
• NSC Number: 40488
• DSSTox Substance ID: DTXSID60417993
• Mol file: 16989-97-2.mol

Synonyms:16989-97-2;AC1NS7R9;DTXSID60417993;NSC40488;NSC-40488

Chemical Property of (3Z)-8-hydroxy-3-(hydroxymethylidene)-10a,12a-dimethyl-4a,4b,5,6,6a,7,8,9,10,10b,11,12-dodecahydro-4H-naphtho[2,1-f]chromen-2-one

Chemical Property:

• Vapor Pressure: 2.38E-12mmHg at 25°C
• Boiling Point: 505.8°C at 760 mmHg
• Flash Point: 177.2°C
• Density: 1.217g/cm³
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 334.21440943
• Heavy Atom Count: 24
• Complexity: 570

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC(CC1CCC3C2CCC4(C3CC(=CO)C(=O)O4)C)O
• Isomeric SMILES: CC12CCC(CC1CCC3C2CCC4(C3C/C(=C/O)/C(=O)O4)C)O