Chemical ID: 6423276

c1cc(ccc1C(CN)c2ccc(cc2)F)F
Chemical ID:
6423276
Name [?]:
2,2-bis(4-fluorophenyl)ethanamine
SMILES [?]:
c1cc(ccc1C(CN)c2ccc(cc2)F)F
InChi [?]:
InChI=1/C14H13F2N/c15-12-5-1-10(2-6-12)14(9-17)11-3-7-13(16)8-4-11/h1-8,14H,9,17H2
InChi Info:
AuxInfo=1/0/N:1,5,11,15,2,4,12,14,8,6,10,3,13,7,17,16,9/E:(1,2,3,4)(5,6,7,8)(10,11)(12,13)(15,16)/rA:17nCCCCCCCCNCCCCCCFF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s7;s10;d11;s12;d13;d10s14;s13;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13F2N
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.8292
Area:396.428
Solvation:-3.0815
Coulombic:-21.9837
Bond Count [?]
All:18
Single:12
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:233.257
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:3.11
LogP (Chemaxon):3.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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