Cas no 72010-19-6 (3-Pentenoic acid,2-propyl-)
3-Pentenoic acid,2-propyl- structure
Product Name:3-Pentenoic acid,2-propyl-
CAS No:72010-19-6
MF:C8H14O2
MW:142.195562839508
CID:570856
PubChem ID:6439747
Update Time:2025-04-19
3-Pentenoic acid,2-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pentenoic acid,2-propyl-
- 2-PROPYL-3-PENTENOIC ACID
- 3-ENEVALPROIC ACID
- 3-Pentenoic acid,2-propyl
- 72010-19-6
- AKOS006272874
- 3-En-valproic acid
- (3E)-2-Propylpent-3-enoic acid (3E-Ene-VPA)
- CHEMBL3706503
- (E)-2-propylpent-3-enoic acid
- (3E)-2-PROPYLPENT-3-ENOIC ACID
- LMFA01030945
- 3-Pentenoic acid, 2-propyl-
- 3-en-VPA
- CHEBI:195734
- SCHEMBL1003227
-
- Inchi： 1S/C8H14O2/c1-3-5-7(6-4-2)8(9)10/h3,5,7H,4,6H2,1-2H3,(H,9,10)/b5-3+
- InChI Key： WTMAHJABDOHPDJ-HWKANZROSA-N
- SMILES： OC(C(/C=C/C)CCC)=O
Computed Properties
- Exact Mass: 142.09900
- Monoisotopic Mass: 142.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- Density: 0.953
- PSA: 37.30000
- LogP: 2.06340
3-Pentenoic acid,2-propyl- Related Literature
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1. 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
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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