Chemical ID: 4147250

C=CCNC(=O)COc1ccc(cc1)Br
Chemical ID:
4147250
Name [?]:
N-allyl-2-(4-bromophenoxy)-acetamide
SMILES [?]:
C=CCNC(=O)COc1ccc(cc1)Br
InChi [?]:
InChI=1/C11H12BrNO2/c1-2-7-13-11(14)8-15-10-5-3-9(12)4-6-10/h2-6H,1,7-8H2,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,11,13,10,14,3,7,12,9,5,15,4,6,8/E:(3,4)(5,6)/rA:15nCCCNCOCOCCCCCCBr/rB:d1;s2;s3;s4;d5;s5;s7;s8;s9;d10;s11;d12;d9s13;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H12BrNO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.9194
Area:421.997
Solvation:-3.63053
Coulombic:-30.1839
Bond Count [?]
All:15
Single:10
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:270.123
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.52
LogP (Chemaxon):2.25

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