Cas no 50417-78-2 (1(2H)-Naphthalenone, 3,4-dihydro-2-propyl-)
50417-78-2 structure
Product Name:1(2H)-Naphthalenone, 3,4-dihydro-2-propyl-
CAS No:50417-78-2
MF:C13H16O
MW:188.265543937683
CID:364925
PubChem ID:10877906
Update Time:2025-04-19
1(2H)-Naphthalenone, 3,4-dihydro-2-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 1(2H)-Naphthalenone, 3,4-dihydro-2-propyl-
- 2-Propyl-1,2,3,4-tetrahydronaphthalen-1-one
- 2-propyl-3,4-dihydro-2H-naphthalen-1-one
- 50417-78-2
- DTXSID50446792
- AKOS011021047
-
- MDL： MFCD16090956
- Inchi： 1S/C13H16O/c1-2-5-11-9-8-10-6-3-4-7-12(10)13(11)14/h3-4,6-7,11H,2,5,8-9H2,1H3
- InChI Key： NEIXTUUIVUTILQ-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2CCC1CCC
Computed Properties
- Exact Mass: 188.12018
- Monoisotopic Mass: 188.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 209
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
1(2H)-Naphthalenone, 3,4-dihydro-2-propyl- Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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