Chemical ID: 7341985

c1ccc(cc1)C(=O)Cc2[nH]ccn2
Chemical ID:
7341985
Name [?]:
2-(1H-imidazol-2-yl)-1-phenyl-ethanone
SMILES [?]:
c1ccc(cc1)C(=O)Cc2[nH]ccn2
InChi [?]:
InChI=1/C11H10N2O/c14-10(8-11-12-6-7-13-11)9-4-2-1-3-5-9/h1-7H,8H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,12,13,9,4,7,10,11,14,8/E:(2,3)(4,5)(6,7)(12,13)/rA:14nCCCCCCCOCCNCCN/rB:s1;d2;s3;d4;d1s5;s4;d7;s7;s9;s10;s11;d12;d10s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H10N2O
All Atoms:24
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.76621
Area:361.898
Solvation:-3.28124
Coulombic:-22.6136
Bond Count [?]
All:15
Single:9
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:186.21
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.34
LogP (Chemaxon):1.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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