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CAS No.: | 482577-59-3 |
---|---|
Name: | L-VALINE, N-[(2'-CYANO[1,1'-BIPHENYL]-4-YL)METHYL]-, METHYL ESTER, MONOHYDROCHLORIDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C20H22N2O2.ClH |
Molecular Weight: | 358.868 |
Synonyms: | L-Valine,N-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-, methyl ester, monohydrochloride(9CI);Methyl N-[(2'-cyanobiphenyl-4-yl)methyl]valinate hydrochloride (1:1);Valine, N-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-, methyl ester, hydrochloride (1:1); |
EINECS: | 610-414-9 |
Melting Point: | 186 °C |
PSA: | 62.12000 |
LogP: | 4.70538 |
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The L-Valine,N-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-, methyl ester, hydrochloride (1:1) with CAS registry number of 482577-59-3 is also known as Valine, N-[(2'-cyano[1,1'-biphenyl]-4-yl)methyl]-, methyl ester, hydrochloride (1:1). The systematic name is Methyl N-[(2'-cyanobiphenyl-4-yl)methyl]valinate hydrochloride (1:1). In addition, the formula is C20H22N2O2.ClH and the molecular weight is 358.86.
You can still convert the following datas into molecular structure:
1. SMILES: CC(C)C(C(=O)OC)NCc1ccc(cc1)c2ccccc2C#N.Cl
2. InChI: InChI=1/C20H22N2O2.ClH/c1-14(2)19(20(23)24-3)22-13-15-8-10-16(11-9-15)18-7-5-4-6-17(18)12-21;/h4-11,14,19,22H,13H2,1-3H3;1H
3. InChIKey: AZQXUWUZQLZNIM-UHFFFAOYAT
4. Std. InChI: InChI=1S/C20H22N2O2.ClH/c1-14(2)19(20(23)24-3)22-13-15-8-10-16(11-9-15)18-7-5-4-6-17(18)12-21;/h4-11,14,19,22H,13H2,1-3H3;1H
5. Std. InChIKey: AZQXUWUZQLZNIM-UHFFFAOYSA-N