Chemical ID: 7061732

CN(C)CCCOc1ccc(cc1)Cl
Chemical ID:
7061732
Name [?]:
3-(4-chlorophenoxy)-N,N-dimethyl-propan-1-amine
SMILES [?]:
CN(C)CCCOc1ccc(cc1)Cl
InChi [?]:
InChI=1/C11H16ClNO/c1-13(2)8-3-9-14-11-6-4-10(12)5-7-11/h4-7H,3,8-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,5,10,12,9,13,4,6,11,8,14,2,7/E:(1,2)(4,5)(6,7)/rA:14nCNCCCCOCCCCCCCl/rB:s1;s2;s2;s4;s5;s6;s7;s8;d9;s10;d11;d8s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H16ClNO
All Atoms:30
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.00778
Area:415.556
Solvation:-2.38113
Coulombic:-13.5957
Bond Count [?]
All:14
Single:11
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:213.704
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.77
LogP (Chemaxon):2.34

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Descriptor Annotations

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