Chemical ID: 4432440

c1cc(ccc1COc2ccc(cc2Cl)CO)F
Chemical ID:
4432440
Name [?]:
[3-chloro-4-[(4-fluorophenyl)methoxy]phenyl]methanol
SMILES [?]:
c1cc(ccc1COc2ccc(cc2Cl)CO)F
InChi [?]:
InChI=1/C14H12ClFO2/c15-13-7-11(8-17)3-6-14(13)18-9-10-1-4-12(16)5-2-10/h1-7,17H,8-9H2
InChi Info:
AuxInfo=1/0/N:1,5,11,2,4,10,13,16,7,6,12,3,14,9,15,18,17,8/E:(1,2)(4,5)/rA:18nCCCCCCCOCCCCCCClCOF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s14;s12;s16;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12ClFO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.73169
Area:450.419
Solvation:-4.5288
Coulombic:-29.8309
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:266.695
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.62
LogP (Chemaxon):3.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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