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Chemical ID: 7092498
Chemical ID:
7092498
Name [?]:
1-methoxy-3-(2-methoxyphenyl)amino-propan-2-ol
SMILES [?]:
COCC(CNc1ccccc1OC)O
InChi [?]:
InChI=1/C11H17NO3/c1-14-8-9(13)7-12-10-5-3-4-6-11(10)15-2/h3-6,9,12-13H,7-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,9,10,8,11,5,3,4,7,12,6,15,2,13/rA:15cCOCCCNCCCCCCOCO/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s12;s13;s4;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H17NO3 |
All Atoms: | 32 |
Heavy Atoms: | 15 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 4.2395 |
Area: | 410.955 |
Solvation: | -6.03437 |
Coulombic: | -43.1723 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 211.258 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 0.72 |
LogP (Chemaxon): | 0.83 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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