Chemical ID: 4778278

CC(=O)Nc1ccc(cc1)C=C[N+](=O)[O-]
Chemical ID:
4778278
Name [?]:
N-[4-(2-nitrovinyl)phenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)C=C[N+](=O)[O-]
InChi [?]:
InChI=1/C10H10N2O3/c1-8(13)11-10-4-2-9(3-5-10)6-7-12(14)15/h2-7H,1H3,(H,11,13)
InChi Info:
AuxInfo=1/1/N:1,7,9,6,10,11,12,2,8,5,4,13,3,14,15/E:(2,3)(4,5)(14,15)/CRV:12.5/rA:15nCCONCCCCCCCCN+OO-/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;w11;s12;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10N2O3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:0.324675
Area:375.267
Solvation:-9.05699
Coulombic:-28.312
Bond Count [?]
All:15
Single:9
Double:6
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:206.198
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.32
LogP (Chemaxon):1.78

Name Annotations

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Descriptor Annotations

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