Chemical ID: 4434534

c1cc(ccc1COc2ccc(cc2Cl)CO)Br
Chemical ID:
4434534
Name [?]:
[4-[(4-bromophenyl)methoxy]-3-chloro-phenyl]methanol
SMILES [?]:
c1cc(ccc1COc2ccc(cc2Cl)CO)Br
InChi [?]:
InChI=1/C14H12BrClO2/c15-12-4-1-10(2-5-12)9-18-14-6-3-11(8-17)7-13(14)16/h1-7,17H,8-9H2
InChi Info:
AuxInfo=1/0/N:1,5,11,2,4,10,13,16,7,6,12,3,14,9,18,15,17,8/E:(1,2)(4,5)/rA:18nCCCCCCCOCCCCCCClCOBr/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s14;s12;s16;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12BrClO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.20685
Area:474.588
Solvation:-3.65786
Coulombic:-26.6262
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.601
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.26
LogP (Chemaxon):4.34

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