Cas no 13586-68-0 (3-(4-(tert-Butyl)-2-methylphenyl)acrylaldehyde)
13586-68-0 structure
Product Name:3-(4-(tert-Butyl)-2-methylphenyl)acrylaldehyde
CAS No:13586-68-0
MF:C14H18O
MW:202.292124271393
CID:154763
PubChem ID:114659
Update Time:2025-04-19
3-(4-(tert-Butyl)-2-methylphenyl)acrylaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-(tert-Butyl)-2-methylphenyl)acrylaldehyde
- 2-Propenal,3-[4-(1,1-dimethylethyl)phenyl]-2-methyl-
- 3-(4-(1,1-dimethylethyl)phenyl)-2-methyl-2-Propenal
- 3-[4-(1,1-dimethylethyl)phenyl]-2-methyl-2-Propenal
- p-tert-butyl-2-methylcinnamaldehyde
- (2E)-3-(4-tert-butylphenyl)-2-methylprop-2-enal
- 2-Propenal, 3-(4-(1,1-dimethylethyl)phenyl)-2-methyl-
- Cinnamaldehyde, p-tert-butyl-alpha-methyl-
- p-tert-butyl-.alpha.-methyl-Cinnamaldehyde
- 3-[4-(1,1-dimethylethyl)phenyl]-2-methyl-2-propena
- 4-TERT-BUTYL CINNAMALDEHYDE
- 4-tert-Butyl-ALPHA-methylcinnamaldehyde
- 3-[4-(1,1-Dimethylethyl)phenyl]-2-methylpropenal
- 3,4-(1,1-DIMETHYLETHYL)PHENYL-2-METHYL-2-PROPENAL
- alpha-methyl-4-tert-butylcinnamaldehyde
- 3-(p-tert.butyl-phenyl)-2-methyl-acrolein
- AKOS017547844
- ZZSXZEFWZXSQPX-UHFFFAOYSA-N
- 13586-68-0
- DTXSID7065546
- 3-(4-tert.-butylphenyl)-2-methylprop-2-enal
- 1-(p-tert.butylphenyl)-2-formyl-1-propene
- 3-p-tertiary butylphenyl-2-methyl-prop-2-enal
- 3-(4-tert-butylphenyl)-2-methylprop-2-enal
- 2-Propenal, 3-[4-(1,1-dimethylethyl)phenyl]-2-methyl-
- DB-063102
-
- Inchi： 1S/C14H18O/c1-11(10-15)9-12-5-7-13(8-6-12)14(2,3)4/h5-10H,1-4H3
- InChI Key： ZZSXZEFWZXSQPX-UHFFFAOYSA-N
- SMILES： O=CC(C)=CC1C=CC(=CC=1)C(C)(C)C
Computed Properties
- Exact Mass: 202.13584
- Monoisotopic Mass: 202.135765
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 237
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 17.1
- XLogP3: 3.9
Experimental Properties
- Density: 0.959
- Boiling Point: 300.8°Cat760mmHg
- Flash Point: 125.2°C
- Refractive Index: 1.53
- PSA: 17.07
3-(4-(tert-Butyl)-2-methylphenyl)acrylaldehyde Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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