Chemical ID: 4396322

c1ccc(cc1)COc2ccc(cc2Cl)C=NO
Chemical ID:
4396322
Name [?]:
4-benzyloxy-3-chloro-benzaldehyde oxime
SMILES [?]:
c1ccc(cc1)COc2ccc(cc2Cl)C=NO
InChi [?]:
InChI=1/C14H12ClNO2/c15-13-8-12(9-16-17)6-7-14(13)18-10-11-4-2-1-3-5-11/h1-9,17H,10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,11,10,13,16,7,4,12,14,9,15,17,18,8/E:(2,3)(4,5)/rA:18nCCCCCCCOCCCCCCClCNO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s14;s12;w16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12ClNO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.02671
Area:454.432
Solvation:-3.33409
Coulombic:-22.6508
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:261.703
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.21
LogP (Chemaxon):3.73

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