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Chemical ID: 6680363
Chemical ID:
6680363
Name [?]:
1-(dimethoxymethyl)-4-methoxy-benzene
SMILES [?]:
COc1ccc(cc1)C(OC)OC
InChi [?]:
InChI=1/C10H14O3/c1-11-9-6-4-8(5-7-9)10(12-2)13-3/h4-7,10H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,11,13,5,7,4,8,6,3,9,2,10,12/E:(2,3)(4,5)(6,7)(12,13)/rA:13nCOCCCCCCCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;s9;s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H14O3 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.25973 |
Area: | 351.808 |
Solvation: | -3.53548 |
Coulombic: | -25.746 |
Bond Count [?]
All: | 13 |
Single: | 10 |
Double: | 3 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 182.216 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | 1.7 |
LogP (Chemaxon): | 1.71 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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