1-Isopropenyl-2-Benzimidazolidinone 1-异丙烯基-2-苯并咪唑酮
CAS 52099-72-6 MFCD00218253
化学结构图
SMILES: C=C(C)n1c(=O)[nH]c2ccccc21
化学属性
| Mol. Formula | C10H10N2O |
|---|---|
| Mol. Weight | 174.20 |
| Melting Point | 121-125 °C |
| TSCA | No |
别名和识别编码
| Chemical Name | 1-Isopropenyl-2-Benzimidazolidinone |
|---|---|
| CAS Number | 72798-66-4 |
| Alfabeta Name | ISOPROPENYLDIHYDROBENZIMIDAZOLONE H1132132--------,, |
| MDL Number | MFCD00218253 |
| Synonym | 1,3-dihydro-1-(1-methylvinyl)-2H-benzimidazol-2-one 1,3-DIHYDRO-1-(1-METHYLETHENYL)-2H-BENZIMIDAZOLE-2-ONE TIMTEC-BB SBB006406 1-ISOPROPENYL-2-BENZIMIDAZOLIDINONE 1,3-二氢-1-(1-甲基乙烯基)-2H-苯并咪唑-2-酮 1-(2-丙烯基)-2-苯并咪唑酮 1-Isopropenyl-1H-benzimidazol-2(3H)-one 2H-Benzimidazol-2-one,1,3-dihydro-1-(1-methylethenyl)-(9CI) IFLAB-BB F0451-0304 1-异丙烯基-2-苯并咪唑酮 1-(prop-1-en-2-yl)-1H-benzo(d)imidazol-2(3H)-one ISOPROPENYL-BENZIMIDAZOLIDINONE-2 1-(2-PROPENYL)-2-BENZIMIDAZOLIDINONE 3-Isopropenyl-1H-benzimidazole-2(3H)-one 1-(methylvinyl)-1H-benzimidazol-2(3H)-one 1,3-Dihydro-1-(1-methylvinyl)-2H-benzimidazol-2-on 1,3-Dihydro-1-(1-methylethenyl)-2H-benzimidazole-2-one, 1-(2-Propenyl)-2-benzimidazolidinone 1,3-Dihydro-1-(1-methylethenyl)-2H-benzimidazole-2-one 1,3-Dihydro-1-(1-methylethenyl)-2H-benzimidazol-2-one 1-Isopropenyl-2-benzimidazolidinone, 98+% 1,3-Dihydro-1-(1-Methylethenyl)-2H-Benzimidazol-2-One 1-ISOPROPENYL-1,3-DIHYDRO-2H-1,3-BENZIMIDAZOL-2-ONE 2-BENZIMIDAZOLINONE,1-ISOPROPENYL 1,3-DIHYDRO-1-(1-METHYLETHENYL)-2H-BENZIMIDAZOLE-2-ONE 99% |
| PubChem Substance ID | 24885491 |
| EC Number | 257-661-5 |
| Beilstein Registry Number | 140587 |
| Chemical Name Translation | 1-异丙烯基-2-苯并咪唑酮 |
| InChIKey | XFASJWLBXHWUMW-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00147952 |
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分类
- {KO} AminesSecondaryHeteroNH
- Aromatics
- {SNA} Benzimidazoles, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks
安全信息
Warnings
IRRITANT
WGK Germany3
GHS Symbol
Precautionary statements
- P301+P310
Hazard statements
- H301 Toxic if swallowed 吞食有毒
Signal word
Danger
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Safety Statements
- S36 Wear suitable protective clothing 穿戴适当的防护服；
- S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
Risk Statements
- R22 Harmful if swallowed 吞咽有害
- R25 Toxic if swallowed 吞咽有毒
Hazard Codes
T
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
1
Rotatable Bonds
1
LogP
5.580000000000001e-001
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