Chemical ID: 4122601

CCOC(=O)c1ccnc(c1)Br
Chemical ID:
4122601
Name [?]:
ethyl 2-bromopyridine-4-carboxylate
SMILES [?]:
CCOC(=O)c1ccnc(c1)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H8BrNO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.11246
Area:353.386
Solvation:-1.72219
Coulombic:-24.716
Bond Count [?]
All:12
Single:8
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:230.059
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.02
LogP (Chemaxon):1.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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