Chemical ID: 4117747

c1cc(ccc1N)OC(F)F
Chemical ID:
4117747
Name [?]:
4-(difluoromethoxy)aniline
SMILES [?]:
c1cc(ccc1N)OC(F)F
InChi [?]:
InChI=1/C7H7F2NO/c8-7(9)11-6-3-1-5(10)2-4-6/h1-4,7H,10H2
InChi Info:
AuxInfo=1/0/N:1,5,2,4,6,3,9,10,11,7,8/E:(1,2)(3,4)(8,9)/rA:11nCCCCCCNOCFF/rB:s1;d2;s3;d4;d1s5;s6;s3;s8;s9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H7F2NO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:4.65409
Area:286.569
Solvation:-2.51015
Coulombic:-36.3974
Bond Count [?]
All:11
Single:8
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:159.133
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.83
LogP (Chemaxon):1.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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