Chemical ID: 6462986

C=CCCCCCCCCC(=O)Nc1ccccc1Br
Chemical ID:
6462986
Name [?]:
N-(2-bromophenyl)undec-10-enamide
SMILES [?]:
C=CCCCCCCCCC(=O)Nc1ccccc1Br
InChi [?]:
InChI=1/C17H24BrNO/c1-2-3-4-5-6-7-8-9-14-17(20)19-16-13-11-10-12-15(16)18/h2,10-13H,1,3-9,14H2,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,17,16,18,15,10,19,14,11,20,13,12/rA:20nCCCCCCCCCCCONCCCCCCBr/rB:d1;s2;s3;s4;s5;s6;s7;s8;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H24BrNO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:12.2309
Area:555.852
Solvation:-1.66536
Coulombic:-24.5343
Bond Count [?]
All:20
Single:15
Double:5
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:338.283
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.51
LogP (Chemaxon):5.1

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Descriptor Annotations

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