Chemical ID: 7154853

CCOc1cc(ccc1OCc2ccccc2Cl)CO
Chemical ID:
7154853
Name [?]:
[4-[(2-chlorophenyl)methoxy]-3-ethoxy-phenyl]methanol
SMILES [?]:
CCOc1cc(ccc1OCc2ccccc2Cl)CO
InChi [?]:
InChI=1/C16H17ClO3/c1-2-19-16-9-12(10-18)7-8-15(16)20-11-13-5-3-4-6-14(13)17/h3-9,18H,2,10-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,14,15,13,16,7,8,5,19,11,6,12,17,9,4,18,20,3,10/rA:20nCCOCCCCCCOCCCCCCCClCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s17;s6;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17ClO3
All Atoms:37
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.57102
Area:501.215
Solvation:-4.95937
Coulombic:-33.7732
Bond Count [?]
All:21
Single:15
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:292.757
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.53
LogP (Chemaxon):3.64

Name Annotations

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Descriptor Annotations

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