Chemical ID: 6358039

CCCC(=O)Nc1ccc(c(c1)F)F
Chemical ID:
6358039
Name [?]:
N-(3,4-difluorophenyl)butanamide
SMILES [?]:
CCCC(=O)Nc1ccc(c(c1)F)F
InChi [?]:
InChI=1/C10H11F2NO/c1-2-3-10(14)13-7-4-5-8(11)9(12)6-7/h4-6H,2-3H2,1H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,3,8,9,12,7,10,11,4,14,13,6,5/rA:14nCCCCONCCCCCCFF/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s11;s10;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11F2NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.5524
Area:357.831
Solvation:-3.39336
Coulombic:-27.1471
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:199.197
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.42
LogP (Chemaxon):2.68

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Descriptor Annotations

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