Chemical ID: 6662581

COc1ccc(cc1)OCCO
Chemical ID:
6662581
Name [?]:
2-(4-methoxyphenoxy)ethanol
SMILES [?]:
COc1ccc(cc1)OCCO
InChi [?]:
InChI=1/C9H12O3/c1-11-8-2-4-9(5-3-8)12-7-6-10/h2-5,10H,6-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,8,5,7,11,10,3,6,12,2,9/E:(2,3)(4,5)/rA:12nCOCCCCCCOCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H12O3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:3.69464
Area:341.645
Solvation:-4.8465
Coulombic:-30.6476
Bond Count [?]
All:12
Single:9
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:168.19
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.14
LogP (Chemaxon):1.1

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Descriptor Annotations

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