Chemical ID: 4663928

C[N+](C)(C)c1ccc(cc1)F
Chemical ID:
4663928
Name [?]:
(4-fluorophenyl)-trimethyl-ammonium
SMILES [?]:
C[N+](C)(C)c1ccc(cc1)F
InChi [?]:
InChI=1/C9H13FN/c1-11(2,3)9-6-4-8(10)5-7-9/h4-7H,1-3H3/q+1
InChi Info:
AuxInfo=1/0/N:1,3,4,7,9,6,10,8,5,11,2/E:(1,2,3)(4,5)(6,7)/CRV:11+1/rA:11nCN+CCCCCCCCF/rB:s1;s2;s2;s2;s5;d6;s7;d8;d5s9;s8;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H13FN+
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:-23.4077
Area:300.852
Solvation:-30.929
Coulombic:22.6159
Bond Count [?]
All:11
Single:8
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:154.205
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.52
LogP (Chemaxon):-2.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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