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Chemical ID: 7257034

Chemical ID:

7257034

Name [?]:

N-[2-(2,4-dichlorophenyl)ethyl]-2-(2-hydroxyethylamino)acetamide

SMILES [?]:

c1cc(c(cc1Cl)Cl)CCNC(=O)CNCCO

InChi [?]:

InChI=1/C12H16Cl2N2O2/c13-10-2-1-9(11(14)7-10)3-4-16-12(18)8-15-5-6-17/h1-2,7,15,17H,3-6,8H2,(H,16,18)

InChi Info:

AuxInfo=1/1/N:2,1,9,10,16,17,5,14,3,6,4,12,7,8,15,11,18,13/rA:18nCCCCCCClClCCNCOCNCCO/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;s10;s11;d12;s12;s14;s15;s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₂H₁₆Cl₂N₂O₂
All Atoms:	34
Heavy Atoms:	18
Chiral Atoms:	0

ZAP Information [?]

Total:	8.11536
Area:	508.565
Solvation:	-4.59876
Coulombic:	-46.0836

Bond Count [?]

All:	18
Single:	14
Double:	4
Rotors:	8
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	291.173
H-Bond Donors:	3
H-Bond Acceptors:	4
XLogP:	1.4
LogP (Chemaxon):	1.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value