1,2-Dihydroxymint lactone

Base Information

• Chemical Name: 1,2-Dihydroxymint lactone
• CAS No.: 168029-69-4
• Molecular Formula: C10H14 O4
• Molecular Weight: 198.2158
• DSSTox Substance ID: DTXSID90331835
• Nikkaji Number: J2.771.232K
• Wikidata: Q27105304
• Mol file: 168029-69-4.mol

Synonyms:1,2-Dihydroxymint lactone;168029-69-4;(6R,7S,7aR)-6,7-dihydroxy-3,6-dimethyl-4,5,7,7a-tetrahydro-1-benzofuran-2-one;C09853;CHEBI:507;DTXSID90331835;Q27105304

Chemical Property of 1,2-Dihydroxymint lactone

Chemical Property:

• Vapor Pressure: 9.38E-08mmHg at 25°C
• Boiling Point: 391.6°C at 760 mmHg
• Flash Point: 158.6°C
• PSA: 66.76000
• Density: 1.32g/cm³
• LogP: 0.13400
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 198.08920892
• Heavy Atom Count: 14
• Complexity: 320

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2CCC(C(C2OC1=O)O)(C)O
• Isomeric SMILES: CC1=C2CC[C@@]([C@H]([C@@H]2OC1=O)O)(C)O