Chemical ID: 4253539

c1cc(ccc1C2CCCN2)C(F)(F)F
Chemical ID:
4253539
Name [?]:
2-[4-(trifluoromethyl)phenyl]pyrrolidine
SMILES [?]:
c1cc(ccc1C2CCCN2)C(F)(F)F
InChi [?]:
InChI=1/C11H12F3N/c12-11(13,14)9-5-3-8(4-6-9)10-2-1-7-15-10/h3-6,10,15H,1-2,7H2
InChi Info:
AuxInfo=1/0/N:9,8,1,5,2,4,10,6,3,7,12,13,14,15,11/E:(3,4)(5,6)(12,13,14)/rA:15cCCCCCCCCCCNCFFF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s7s10;s3;s12;s12;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H12F3N
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.33466
Area:356.027
Solvation:-1.56601
Coulombic:-28.984
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:215.215
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.07
LogP (Chemaxon):2.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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