N-Boc-aminomalamido-N,N'-Diacetic di-tert-Butyl Ester - CAS 1346600-93-8
Catalog: |
BB072490 |
Product Name: |
N-Boc-aminomalamido-N,N'-Diacetic di-tert-Butyl Ester |
CAS: |
1346600-93-8 |
Synonyms: |
N-Boc-aminomalamido-N,N'-Diacetic di-tert-Butyl Ester; tert-butyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-oxopropanoyl]amino]acetate |
IUPAC Name: | tert-butyl 2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-oxopropanoyl]amino]acetate |
Description: | N-Boc-aminomalamido-N,N'-Diacetic di-tert-Butyl Ester (cas# 1346600-93-8) is a compound useful in organic synthesis. |
Molecular Weight: | 445.51 |
Molecular Formula: | C20H35N3O8 |
Canonical SMILES: | CC(C)(C)OC(=O)CNC(=O)C(C(=O)NCC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C20H35N3O8/c1-18(2,3)29-12(24)10-21-15(26)14(23-17(28)31-20(7,8)9)16(27)22-11-13(25)30-19(4,5)6/h14H,10-11H2,1-9H3,(H,21,26)(H,22,27)(H,23,28) |
InChI Key: | UTNMZRQXGAMGBB-UHFFFAOYSA-N |
Solubility: | Chloroform, Dichloromethane |
Appearance: | White Crystalline Solid |
Complexity: | 640 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 445.24241508 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 445.24241508 |
Rotatable Bond Count: | 13 |
Topological Polar Surface Area: | 149Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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