Cas no 51093-03-9 (prop-2-enoic acid - prop-2-en-1-amine (1:1))
51093-03-9 structure
Product Name:prop-2-enoic acid - prop-2-en-1-amine (1:1)
CAS No:51093-03-9
MF:C6H11NO2
MW:129.157041788101
CID:1571737
PubChem ID:6452339
Update Time:2025-04-21
prop-2-enoic acid - prop-2-en-1-amine (1:1) Chemical and Physical Properties
Names and Identifiers
-
- prop-2-enoic acid - prop-2-en-1-amine (1:1)
- prop-2-en-1-amine,prop-2-enoic acid
- DTXSID00965367
- SCHEMBL3136195
- 51093-03-9
- Prop-2-enoic acid--prop-2-en-1-amine (1/1)
-
- Inchi： 1S/C3H7N.C3H4O2/c1-2-3-4;1-2-3(4)5/h2H,1,3-4H2;2H,1H2,(H,4,5)
- InChI Key： VVZLMVQGOQOHOU-UHFFFAOYSA-N
- SMILES： OC(C=C)=O.NCC=C
Computed Properties
- Exact Mass: 129.07903
- Monoisotopic Mass: 129.078979
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 73.2
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 63.3
Experimental Properties
- Boiling Point: 141°C at 760 mmHg
- Flash Point: 61.6°C
- PSA: 63.32
prop-2-enoic acid - prop-2-en-1-amine (1:1) Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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2. 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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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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