Chemical ID: 4115730

Cc1c(c(c(c(c1Br)Br)O)Br)Br
Chemical ID:
4115730
Name [?]:
2,3,5,6-tetrabromo-4-methyl-phenol
SMILES [?]:
Cc1c(c(c(c(c1Br)Br)O)Br)Br
InChi [?]:
InChI=1/C7H4Br4O/c1-2-3(8)5(10)7(12)6(11)4(2)9/h12H,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,7,4,6,5,12,8,11,9,10/E:(3,4)(5,6)(8,9)(10,11)/rA:12nCCCCCCCBrBrOBrBr/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s5;s4;s3;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H4Br4O
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.50615
Area:352.621
Solvation:-1.30938
Coulombic:-16.3571
Bond Count [?]
All:12
Single:9
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:423.722
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.03
LogP (Chemaxon):5.4

Name Annotations

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Descriptor Annotations

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