Chemical ID: 6049062

CC(C)(C)OC(=O)Nc1cc(ccn1)Cl
Chemical ID:
6049062
Name [?]:
tert-butyl (4-chloro-2-pyridyl)aminoformate
SMILES [?]:
CC(C)(C)OC(=O)Nc1cc(ccn1)Cl
InChi [?]:
InChI=1/C10H13ClN2O2/c1-10(2,3)15-9(14)13-8-6-7(11)4-5-12-8/h4-6H,1-3H3,(H,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,4,12,13,10,11,9,6,2,15,14,8,7,5/E:(1,2,3)/rA:15nCCCCOCONCCCCCNCl/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s11;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H13ClN2O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.82855
Area:403.316
Solvation:-2.25434
Coulombic:-37.4342
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:228.675
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.84
LogP (Chemaxon):2.74

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