Chemical ID: 6657934

Cc1cc(c(c(c1Cl)C)C)O
Chemical ID:
6657934
Name [?]:
4-chloro-2,3,5-trimethyl-phenol
SMILES [?]:
Cc1cc(c(c(c1Cl)C)C)O
InChi [?]:
InChI=1/C9H11ClO/c1-5-4-8(11)6(2)7(3)9(5)10/h4,11H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,10,9,3,2,5,6,4,7,8,11/rA:11nCCCCCCCClCCO/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s5;s4;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H11ClO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.76396
Area:320.789
Solvation:-1.25577
Coulombic:-17.3005
Bond Count [?]
All:11
Single:8
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:170.636
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.92
LogP (Chemaxon):3.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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