Chemical ID: 6674701

c1cc(cc(c1)F)NC(=O)Oc2ccc(cc2Br)Br
Chemical ID:
6674701
Name [?]:
(2,4-dibromophenyl) (3-fluorophenyl)aminoformate
SMILES [?]:
c1cc(cc(c1)F)NC(=O)Oc2ccc(cc2Br)Br
InChi [?]:
InChI=1/C13H8Br2FNO2/c14-8-4-5-12(11(15)6-8)19-13(18)17-10-3-1-2-9(16)7-10/h1-7H,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,6,2,14,13,16,4,15,5,3,17,12,9,19,18,7,8,10,11/rA:19nCCCCCCFNCOOCCCCCCBrBr/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H8Br2FNO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.42153
Area:459.844
Solvation:-2.07457
Coulombic:-38.2248
Bond Count [?]
All:20
Single:13
Double:7
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:389.015
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.77
LogP (Chemaxon):5.4

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