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Chemical ID: 6323615
Chemical ID:
6323615
Name [?]:
N-(2,4,5-trichlorophenyl)cyclopropanecarboxamide
SMILES [?]:
c1c(c(cc(c1Cl)Cl)Cl)NC(=O)C2CC2
InChi [?]:
InChI=1/C10H8Cl3NO/c11-6-3-8(13)9(4-7(6)12)14-10(15)5-1-2-5/h3-5H,1-2H2,(H,14,15)
InChi Info:
AuxInfo=1/1/N:14,15,4,1,13,5,6,3,2,11,8,7,9,10,12/E:(1,2)/rA:15nCCCCCCClClClNCOCCC/rB:s1;d2;s3;d4;d1s5;s6;s5;s3;s2;s10;d11;s11;s13;s13s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H8Cl3NO |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.13005 |
Area: | 425.499 |
Solvation: | -1.50743 |
Coulombic: | -21.3982 |
Bond Count [?]
All: | 16 |
Single: | 12 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 264.535 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 3.35 |
LogP (Chemaxon): | 2.96 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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