Cas no 355387-54-1 (1,3-Benzenediol, 2,4-dipropyl-)
355387-54-1 structure
Product Name:1,3-Benzenediol, 2,4-dipropyl-
CAS No:355387-54-1
MF:C12H18O2
MW:194.270123958588
CID:1471023
PubChem ID:11715335
Update Time:2025-04-20
1,3-Benzenediol, 2,4-dipropyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenediol, 2,4-dipropyl-
- 2,4-dipropylbenzene-1,3-diol
- SCHEMBL4011837
- JJWMIFAPVZNHOT-UHFFFAOYSA-N
- DTXSID20471031
- 2,4-dipropylresorcinol
- DA-06494
- 355387-54-1
-
- Inchi： 1S/C12H18O2/c1-3-5-9-7-8-11(13)10(6-4-2)12(9)14/h7-8,13-14H,3-6H2,1-2H3
- InChI Key： JJWMIFAPVZNHOT-UHFFFAOYSA-N
- SMILES： OC1C(=CC=C(C=1CCC)O)CCC
Computed Properties
- Exact Mass: 194.13074
- Monoisotopic Mass: 194.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 158
- 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: 3.9
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.46
1,3-Benzenediol, 2,4-dipropyl- Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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4. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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