Chemical ID: 5138015

c1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)Br)O
Chemical ID:
5138015
Name [?]:
(4-bromophenyl)-diphenyl-methanol
SMILES [?]:
c1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)Br)O
InChi [?]:
InChI=1/C19H15BrO/c20-18-13-11-17(12-14-18)19(21,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,21H
InChi Info:
AuxInfo=1/0/N:1,11,2,6,10,12,3,5,9,13,15,19,16,18,4,8,14,17,7,20,21/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(15,16)/rA:21nCCCCCCCCCCCCCCCCCCCBrO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s7;s14;d15;s16;d17;d14s18;s17;s7;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15BrO
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.074
Area:472.835
Solvation:-1.74684
Coulombic:-23.6691
Bond Count [?]
All:23
Single:14
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:339.226
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.55
LogP (Chemaxon):5.95

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Descriptor Annotations

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