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Chemical ID: 7430623
Chemical ID:
7430623
Name [?]:
2-(2-methoxyphenoxy)norbornane
SMILES [?]:
COc1ccccc1OC2CC3CCC2C3
InChi [?]:
InChI=1/C14H18O2/c1-15-12-4-2-3-5-13(12)16-14-9-10-6-7-11(14)8-10/h2-5,10-11,14H,6-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,5,6,4,7,13,14,16,11,12,15,3,8,10,2,9/rA:16cCOCCCCCCOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;s11;s12;s13;s10s14;s12s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H18O2 |
All Atoms: | 34 |
Heavy Atoms: | 16 |
Chiral Atoms: | 3 |
ZAP Information [?]
Total: | 6.00651 |
Area: | 386.942 |
Solvation: | -3.66705 |
Coulombic: | -16.127 |
Bond Count [?]
All: | 18 |
Single: | 15 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 218.292 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 3.31 |
LogP (Chemaxon): | 2.96 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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