1-(4,5-Methylenedioxy-2-Nitrophenyl)-4,4-Dimethyl-1-Penten-3-Ol
[CAS# 58345-07-6]

Identification

• Name: 1-(4,5-Methylenedioxy-2-Nitrophenyl)-4,4-Dimethyl-1-Penten-3-Ol
• Synonyms: 1-Penten-3-Ol, 4,4-Dimethyl-1-(4,5-Methylenedioxy-2-Nitrophenyl)-; 4,4-Dimethyl-1-(4,5-Methylenedioxy-2-Nitrophenyl)-1-Penten-3-Ol; Brn 1321238
• Molecular Formula: C₁₄H₁₇NO₅
• Molecular Weight: 279.29
• CAS Registry Number: 58345-07-6
• SMILES: C2=C1OCOC1=CC(=C2[N+]([O-])=O)\C=C\C(O)C(C)(C)C
• InChI: 1S/C14H17NO5/c1-14(2,3)13(16)5-4-9-6-11-12(20-8-19-11)7-10(9)15(17)18/h4-7,13,16H,8H2,1-3H3/b5-4+
• InChIKey: DJFKZMWDVNBWLK-SNAWJCMRSA-N

Properties

• Density: 1.285g/cm³ (Cal.)
• Boiling point: 438.567°C at 760 mmHg (Cal.)
• Flash point: 219.038°C (Cal.)