1,6,8-Trihydroxy-3,4,5-trimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid

Base Information

• Chemical Name: 1,6,8-Trihydroxy-3,4,5-trimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid
• CAS No.: 162810-06-2
• Molecular Formula: C13H16 O6
• DSSTox Substance ID: DTXSID50552988
• Nikkaji Number: J2.964.444F
• Mol file: 162810-06-2.mol

Synonyms:1,6,8-Trihydroxy-3,4,5-trimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid;162810-06-2;DTXSID50552988

Chemical Property of 1,6,8-Trihydroxy-3,4,5-trimethyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 268.09468823
• Heavy Atom Count: 19
• Complexity: 359

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(OC(C2=C(C(=C(C(=C12)C)O)C(=O)O)O)O)C