94888-12-7 Purity
96%
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Specification
The molecular formula of Boc-L-isoleucine amide is C11H22N2O3.
The molecular weight of Boc-L-isoleucine amide is 230.30 g/mol.
The IUPAC name of Boc-L-isoleucine amide is tert-butyl N-[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]carbamate.
The InChI of Boc-L-isoleucine amide is InChI=1S/C11H22N2O3/c1-6-7(2)8(9(12)14)13-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H2,12,14)(H,13,15)/t7-,8-/m0/s1.
The InChIKey of Boc-L-isoleucine amide is ZXLNERXKXKBCJS-YUMQZZPRSA-N.
The canonical SMILES of Boc-L-isoleucine amide is CCC(C)C(C(=O)N)NC(=O)OC(C)(C)C.
The isomeric SMILES of Boc-L-isoleucine amide is CC[C@H](C)[C@@H](C(=O)N)NC(=O)OC(C)(C)C.
The XLogP3 value of Boc-L-isoleucine amide is 1.4.
Boc-L-isoleucine amide has 2 hydrogen bond donor counts.
Boc-L-isoleucine amide has 6 rotatable bond counts.