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Chemical ID: 5569843

Chemical ID:

5569843

Name [?]:

3-(3-hydroxyphenyl)azophenol

SMILES [?]:

c1cc(cc(c1)O)N=Nc2cccc(c2)O

InChi [?]:

InChI=1/C12H10N2O2/c15-11-5-1-3-9(7-11)13-14-10-4-2-6-12(16)8-10/h1-8,15-16H

InChi Info:

AuxInfo=1/0/N:1,12,2,11,6,13,4,15,3,10,5,14,8,9,7,16/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)/rA:16nCCCCCCONNCCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s3;w8;s9;s10;d11;s12;d13;d10s14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₂H₁₀N₂O₂
All Atoms:	16
Heavy Atoms:	16
Chiral Atoms:	0

ZAP Information [?]

Total:	6.0605
Area:	371.617
Solvation:	-3.22992
Coulombic:	-36.1028

Bond Count [?]

All:	17
Single:	10
Double:	7
Rotors:	2
Chiral:	1
Rigid Segments:	3

Chemical Properties

Molecular Weight:	214.22
H-Bond Donors:	2
H-Bond Acceptors:	4
XLogP:	2.9
LogP (Chemaxon):	3.78

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value