Chemical ID: 7007100

CCOc1ccc(c2c1cccc2)C(=O)NN
Chemical ID:
7007100
Name [?]:
4-ethoxynaphthalene-1-carbohydrazide
SMILES [?]:
CCOc1ccc(c2c1cccc2)C(=O)NN
InChi [?]:
InChI=1/C13H14N2O2/c1-2-17-12-8-7-11(13(16)15-14)9-5-3-4-6-10(9)12/h3-8H,2,14H2,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,2,12,11,13,10,6,5,8,9,7,4,14,17,16,15,3/rA:17nCCOCCCCCCCCCCCONN/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s11;s8d12;s7;d14;s14;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H14N2O2
All Atoms:31
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.74359
Area:409.277
Solvation:-3.48835
Coulombic:-36.5601
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:230.263
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.03
LogP (Chemaxon):1.78

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue