Chemical ID: 7089872

CC(C)Nc1ccc(cc1)OC
Chemical ID:
7089872
Name [?]:
N-isopropyl-4-methoxy-aniline
SMILES [?]:
CC(C)Nc1ccc(cc1)OC
InChi [?]:
InChI=1/C10H15NO/c1-8(2)11-9-4-6-10(12-3)7-5-9/h4-8,11H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,12,6,10,7,9,2,5,8,4,11/E:(1,2)(4,5)(6,7)/rA:12nCCCNCCCCCCOC/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H15NO
All Atoms:27
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.51765
Area:345.946
Solvation:-2.13099
Coulombic:-19.4868
Bond Count [?]
All:12
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:165.232
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.47
LogP (Chemaxon):2.12

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Experimental Annotations

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Descriptor Annotations

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