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Chemical ID: 7513335
Chemical ID:
7513335
Name [?]:
N-[2-(2-bromophenoxy)ethyl]-2-methoxy-ethanamine
SMILES [?]:
COCCNCCOc1ccccc1Br
InChi [?]:
InChI=1/C11H16BrNO2/c1-14-8-6-13-7-9-15-11-5-3-2-4-10(11)12/h2-5,13H,6-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,10,4,6,3,7,14,9,15,5,2,8/rA:15nCOCCNCCOCCCCCCBr/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H16BrNO2 |
All Atoms: | 31 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 6.49622 |
Area: | 432.473 |
Solvation: | -4.3156 |
Coulombic: | -24.357 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 7 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.16 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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