Chemical ID: 4864988

CCOC(=O)CCNC(=O)c1ccccc1Br
Chemical ID:
4864988
Name [?]:
ethyl 3-(2-bromobenzoyl)aminopropanoate
SMILES [?]:
CCOC(=O)CCNC(=O)c1ccccc1Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H14BrNO3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.38117
Area:457.588
Solvation:-3.05853
Coulombic:-39.9185
Bond Count [?]
All:17
Single:12
Double:5
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:300.148
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.51
LogP (Chemaxon):1.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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