526452

2,4,5-トリメチルベンズアルデヒド

90%

• 化学式: (CH₃)₃C₆H₂CHO
• CAS番号: 5779-72-6
• 分子量: 148.20
• MDL番号: MFCD00017713
• UNSPSCコード: 12352100
• PubChem Substance ID: 24874554
• NACRES: NA.22

特性

• アッセイ: 90%
• 不純物: 7% 5-bromo-1,2,4-trimethylbenzene
• mp: 41-46 °C (lit.)
• SMILES記法: [H]C(=O)c1cc(C)c(C)cc1C
• InChI: 1S/C10H12O/c1-7-4-9(3)10(6-11)5-8(7)2/h4-6H,1-3H3
• InChI Key: LROJZZICACKNJL-UHFFFAOYSA-N

詳細

詳細

Dipole moments of 2,4,5-trimethylbenzaldehyde (TMB) isolated in a durene host crystal have been reported to be 1.65 ± 0.09D (difference between the ground state and the lowest singlet) and 1.05 ± 0.06D (difference between the ground state and triplet excited states). TMB has been identified as one of the major volatile constituent present in the leave extracts of Eryngium foetidum L. Based on the phosphorescence excitation and Stark spectral data, it has been observed that a change in temperature and electric field causes a change in the dipole moment of the compound.

安全性情報

• ピクトグラム: GHS07
• シグナルワード: Warning
• 危険有害性情報: H315,H319,H335
• 注意書き: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• 危険有害性の分類: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• ターゲットの組織: Respiratory system
• 保管分類コード: 11 - Combustible Solids
• WGK: WGK 3
• 引火点(°F): 230.0 °F - closed cup
• 引火点(℃): 110 °C - closed cup