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Chemical ID: 6477254
Chemical ID:
6477254
Name [?]:
N-(2-bromo-4,6-difluoro-phenyl)cyclopropanecarboxamide
SMILES [?]:
c1c(cc(c(c1F)NC(=O)C2CC2)Br)F
InChi [?]:
InChI=1/C10H8BrF2NO/c11-7-3-6(12)4-8(13)9(7)14-10(15)5-1-2-5/h3-5H,1-2H2,(H,14,15)
InChi Info:
AuxInfo=1/1/N:12,13,3,1,11,2,4,6,5,9,14,15,7,8,10/E:(1,2)/rA:15nCCCCCCFNCOCCCBrF/rB:s1;d2;s3;d4;d1s5;s6;s5;s8;d9;s9;s11;s11s12;s4;s2;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H8BrF2NO |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.84622 |
Area: | 370.239 |
Solvation: | -3.40975 |
Coulombic: | -26.1769 |
Bond Count [?]
All: | 16 |
Single: | 12 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 276.077 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 2.6 |
LogP (Chemaxon): | 1.83 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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