Chemical ID: 6514170

CC(CO)NC(=O)OC(C)(C)C
Chemical ID:
6514170
Name [?]:
tert-butyl (2-hydroxy-1-methyl-ethyl)aminoformate
SMILES [?]:
CC(CO)NC(=O)OC(C)(C)C
InChi [?]:
InChI=1/C8H17NO3/c1-6(5-10)9-7(11)12-8(2,3)4/h6,10H,5H2,1-4H3,(H,9,11)
InChi Info:
AuxInfo=1/1/N:1,10,11,12,3,2,6,9,5,4,7,8/E:(2,3,4)/rA:12cCCCONCOOCCCC/rB:s1;s2;s3;s2;s5;d6;s6;s8;s9;s9;s9;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H17NO3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.54537
Area:354.319
Solvation:-2.31259
Coulombic:-50.3903
Bond Count [?]
All:11
Single:10
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:175.226
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.93
LogP (Chemaxon):0.64

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Descriptor Annotations

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