Cas no 115436-61-8 (1,3-Benzenedicarboxaldehyde, 2,5-dimethyl-)
115436-61-8 structure
Product Name:1,3-Benzenedicarboxaldehyde, 2,5-dimethyl-
CAS No:115436-61-8
MF:C10H10O2
MW:162.185203075409
CID:1204691
PubChem ID:14045529
Update Time:2025-04-20
1,3-Benzenedicarboxaldehyde, 2,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenedicarboxaldehyde, 2,5-dimethyl-
- 2,5-dimethylbenzene-1,3-dicarbaldehyde
- DTXSID50554962
- 115436-61-8
-
- Inchi： 1S/C10H10O2/c1-7-3-9(5-11)8(2)10(4-7)6-12/h3-6H,1-2H3
- InChI Key： QRQWWOMGFKTGTH-UHFFFAOYSA-N
- SMILES： O=CC1C=C(C)C=C(C=O)C=1C
Computed Properties
- Exact Mass: 162.0681
- Monoisotopic Mass: 162.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 159
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
1,3-Benzenedicarboxaldehyde, 2,5-dimethyl- Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
115436-61-8 (1,3-Benzenedicarboxaldehyde, 2,5-dimethyl-) Related Products
- 643-79-8(Phthalaldehyde)
- 17432-38-1(Pentamethylbenzaldehyde)
- 5779-93-1(2,3-Dimethylbenzaldehyde)
- 5779-94-2(2,5-Dimethylbenzaldehyde)
- 1123-56-4(2,6-Dimethylbenzaldehyde)
- 7149-49-7(Naphthalene-2,3-dicarboxaldehyde)
- 5973-71-7(3,4-Dimethylbenzaldehyde)
- 487-68-3(2,4,6-Trimethylbenzaldehyde)
- 529-20-4(2-Methylbenzaldehyde)
- 15764-16-6(2,4-Dimethylbenzaldehyde)
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