Chemical ID: 5249040

CC(=O)Oc1ccc(cc1)Br
Chemical ID:
5249040
Name [?]:
(4-bromophenyl) acetate
SMILES [?]:
CC(=O)Oc1ccc(cc1)Br
InChi [?]:
InChI=1/C8H7BrO2/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,1H3
InChi Info:
AuxInfo=1/0/N:1,7,9,6,10,2,8,5,11,3,4/E:(2,3)(4,5)/rA:11nCCOOCCCCCCBr/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H7BrO2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.5564
Area:326.878
Solvation:-1.61555
Coulombic:-18.0652
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:215.044
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.61
LogP (Chemaxon):2.34

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