Chemical ID: 6319055

CC(C)(C)NC(=O)Cc1ccc(cc1)Cl
Chemical ID:
6319055
Name [?]:
2-(4-chlorophenyl)-N-tert-butyl-acetamide
SMILES [?]:
CC(C)(C)NC(=O)Cc1ccc(cc1)Cl
InChi [?]:
InChI=1/C12H16ClNO/c1-12(2,3)14-11(15)8-9-4-6-10(13)7-5-9/h4-7H,8H2,1-3H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,3,4,10,14,11,13,8,9,12,6,2,15,5,7/E:(1,2,3)(4,5)(6,7)/rA:15nCCCCNCOCCCCCCCCl/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H16ClNO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.45414
Area:413.1
Solvation:-1.87335
Coulombic:-21.86
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:225.714
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.16
LogP (Chemaxon):2.41

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