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Chemical ID: 6432477
Chemical ID:
6432477
Name [?]:
N-(2,3-dichlorophenyl)-3,3-dimethyl-2-oxo-norbornane-1-carboxamide
SMILES [?]:
CC1(C2CCC(C2)(C1=O)C(=O)Nc3cccc(c3Cl)Cl)C
InChi [?]:
InChI=1/C16H17Cl2NO2/c1-15(2)9-6-7-16(8-9,13(15)20)14(21)19-11-5-3-4-10(17)12(11)18/h3-5,9H,6-8H2,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,21,15,16,14,4,5,7,3,17,13,18,8,10,2,6,20,19,12,9,11/E:(1,2)/rA:21cCCCCCCCCOCONCCCCCCClClC/rB:s1;s2;s3;s4;s5;s3s6;s2s6;d8;s6;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s17;s2;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H17Cl2NO2 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 9.84803 |
Area: | 488.108 |
Solvation: | -2.35468 |
Coulombic: | -30.1322 |
Bond Count [?]
All: | 23 |
Single: | 18 |
Double: | 5 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 326.217 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 3.49 |
LogP (Chemaxon): | 4.57 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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