Cas no 62056-29-5 (Benzene, 1-nitro-4-(3-phenyl-2-propenyl)-)
62056-29-5 structure
Product Name:Benzene, 1-nitro-4-(3-phenyl-2-propenyl)-
CAS No:62056-29-5
MF:C15H13NO2
MW:239.269223928452
CID:459534
PubChem ID:71390385
Update Time:2025-04-19
Benzene, 1-nitro-4-(3-phenyl-2-propenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-nitro-4-(3-phenyl-2-propenyl)-
- 1-nitro-4-(3-phenylprop-2-enyl)benzene
- 1-Nitro-4-(3-phenylprop-2-en-1-yl)benzene
- 62056-29-5
- DTXSID90812295
-
- Inchi： 1S/C15H13NO2/c17-16(18)15-11-9-14(10-12-15)8-4-7-13-5-2-1-3-6-13/h1-7,9-12H,8H2
- InChI Key： KHCQUSCVVIKRFC-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC(=CC=1)CC=CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 239.09469
- Monoisotopic Mass: 239.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 281
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.3
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
Benzene, 1-nitro-4-(3-phenyl-2-propenyl)- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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