Cas no 556068-57-6 (Dodecanoic acid, 3-amino-, methyl ester, (3S)-)
556068-57-6 structure
Product Name:Dodecanoic acid, 3-amino-, methyl ester, (3S)-
CAS No:556068-57-6
MF:C13H27NO2
MW:229.358984231949
CID:1598202
Update Time:2024-09-13
Dodecanoic acid, 3-amino-, methyl ester, (3S)- Chemical and Physical Properties
Names and Identifiers
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- Dodecanoic acid, 3-amino-, methyl ester, (3S)-
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- Inchi： 1S/C13H27NO2/c1-3-4-5-6-7-8-9-10-12(14)11-13(15)16-2/h12H,3-11,14H2,1-2H3/t12-/m0/s1
- InChI Key： VCNWFSUGEKTUEP-LBPRGKRZSA-N
- SMILES： C(OC)(=O)C[C@@H](N)CCCCCCCCC
Computed Properties
- Exact Mass: 229.20431
Experimental Properties
- Density: 0.915±0.06 g/cm3(Predicted)
- Boiling Point: 310.9±25.0 °C(Predicted)
- PSA: 52.32
- pka: 8.84±0.46(Predicted)
Dodecanoic acid, 3-amino-, methyl ester, (3S)- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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