Chemical ID: 4948843

CCNC(=O)C(C)Br
Chemical ID:
4948843
Name [?]:
2-bromo-N-ethyl-propanamide
SMILES [?]:
CCNC(=O)C(C)Br
InChi [?]:
InChI=1/C5H10BrNO/c1-3-7-5(8)4(2)6/h4H,3H2,1-2H3,(H,7,8)
InChi Info:
AuxInfo=1/1/N:1,7,2,6,4,8,3,5/rA:8cCCNCOCCBr/rB:s1;s2;s3;d4;s4;s6;s6;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H10BrNO
All Atoms:8
Heavy Atoms:8
Chiral Atoms:1
ZAP Information [?]
Total:5.76086
Area:294.641
Solvation:-1.60517
Coulombic:-20.7924
Bond Count [?]
All:7
Single:6
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:180.043
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.0
LogP (Chemaxon):0.75

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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