Chemical ID: 6670432

CCC(=O)c1ccc(cc1Cl)Cl
Chemical ID:
6670432
Name [?]:
1-(2,4-dichlorophenyl)propan-1-one
SMILES [?]:
CCC(=O)c1ccc(cc1Cl)Cl
InChi [?]:
InChI=1/C9H8Cl2O/c1-2-9(12)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,7,6,9,8,5,10,3,12,11,4/rA:12nCCCOCCCCCCClCl/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s8;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8Cl2O
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.96491
Area:357.802
Solvation:-1.98014
Coulombic:-8.61497
Bond Count [?]
All:12
Single:8
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:203.065
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.36
LogP (Chemaxon):3.02

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Descriptor Annotations

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