Cas no 112979-62-1 (Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)-)
![Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)- structure](https://ossimg.kuujia.com/scimg/113000/112979-62-1x500.png)
112979-62-1 structure
Product Name:Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)-
CAS No:112979-62-1
MF:C12H17NO2
MW:207.268883466721
CID:1200853
Update Time:2024-08-02
Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)-
- methyl (3S)-3-(benzylamino)butanoate
- Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)- (9CI)
-
- Inchi： 1S/C12H17NO2/c1-10(8-12(14)15-2)13-9-11-6-4-3-5-7-11/h3-7,10,13H,8-9H2,1-2H3/t10-/m0/s1
- InChI Key： BNNDKMWWUARZGQ-JTQLQIEISA-N
- SMILES： C(OC)(=O)C[C@@H](NCC1=CC=CC=C1)C
Experimental Properties
- Density: 1.031±0.06 g/cm3(Predicted)
- Boiling Point: 301.1±25.0 °C(Predicted)
- pka: 8.03±0.19(Predicted)
Butanoic acid, 3-[(phenylmethyl)amino]-, methyl ester, (S)- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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