Chemical ID: 5832320

COCCNCc1ccc(cc1)C(F)(F)F
Chemical ID:
5832320
Name [?]:
2-methoxy-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamine
SMILES [?]:
COCCNCc1ccc(cc1)C(F)(F)F
InChi [?]:
InChI=1/C11H14F3NO/c1-16-7-6-15-8-9-2-4-10(5-3-9)11(12,13)14/h2-5,15H,6-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,12,9,11,4,3,6,7,10,13,14,15,16,5,2/E:(2,3)(4,5)(12,13,14)/rA:16nCOCCNCCCCCCCCFFF/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s10;s13;s13;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14F3NO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:6.84416
Area:407.017
Solvation:-3.33127
Coulombic:-36.3376
Bond Count [?]
All:16
Single:13
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:233.23
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.27
LogP (Chemaxon):2.29

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Descriptor Annotations

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