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Chemical ID: 6681239
Chemical ID:
6681239
Name [?]:
tert-butyl 2-tert-butoxycarbonylaminoacetate
SMILES [?]:
CC(C)(C)OC(=O)CNC(=O)OC(C)(C)C
InChi [?]:
InChI=1/C11H21NO4/c1-10(2,3)15-8(13)7-12-9(14)16-11(4,5)6/h7H2,1-6H3,(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,3,4,14,15,16,8,6,10,2,13,9,7,11,5,12/E:(1,2,3)(4,5,6)/rA:16nCCCCOCOCNCOOCCCC/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;d10;s10;s12;s13;s13;s13;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H21NO4 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.86005 |
Area: | 433.474 |
Solvation: | -1.9768 |
Coulombic: | -52.71 |
Bond Count [?]
All: | 15 |
Single: | 13 |
Double: | 2 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 231.289 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.18 |
LogP (Chemaxon): | 1.08 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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