Chemical ID: 6048867

C(CC(=NO)N)CBr
Chemical ID:
6048867
Name [?]:
1-amino-4-bromo-butan-1-one oxime
SMILES [?]:
C(CC(=NO)N)CBr
InChi [?]:
InChI=1/C4H9BrN2O/c5-3-1-2-4(6)7-8/h8H,1-3H2,(H2,6,7)
InChi Info:
AuxInfo=1/1/N:1,2,7,3,8,6,4,5/rA:8nCCCNONCBr/rB:s1;s2;w3;s4;s3;s1;s7;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C4H9BrN2O
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:5.71338
Area:297.618
Solvation:-1.72707
Coulombic:-29.2586
Bond Count [?]
All:7
Single:6
Double:1
Rotors:3
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:181.031
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:1.04
LogP (Chemaxon):0.19

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Descriptor Annotations

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