Chemical ID: 6681239

CC(C)(C)OC(=O)CNC(=O)OC(C)(C)C
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

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Descriptor Annotations

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