Chemical ID: 6681474

c1ccc2c(c1)cc3ccccc3c2Br
Chemical ID:
6681474
Name [?]:
9-bromoanthracene
SMILES [?]:
c1ccc2c(c1)cc3ccccc3c2Br
InChi [?]:
InChI=1/C14H9Br/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H
InChi Info:
AuxInfo=1/0/N:1,10,2,11,6,9,3,12,7,5,8,4,13,14,15/E:(1,2)(3,4)(5,6)(7,8)(10,11)(12,13)/rA:15nCCCCCCCCCCCCCCBr/rB:s1;d2;s3;s4;d1s5;d5;s7;s8;d9;s10;d11;d8s12;d4s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H9Br
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.33523
Area:362.465
Solvation:-0.726407
Coulombic:-3.94449
Bond Count [?]
All:17
Single:10
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:257.125
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.35
LogP (Chemaxon):4.84

Name Annotations

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Descriptor Annotations

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