Chemical ID: 4143589

Cc1ccc(c(c1)C(C)(C)C)OCc2ccc(cc2)Cl
Chemical ID:
4143589
Name [?]:
1-[(4-chlorophenyl)methoxy]-4-methyl-2-tert-butyl-benzene
SMILES [?]:
Cc1ccc(c(c1)C(C)(C)C)OCc2ccc(cc2)Cl
InChi [?]:
InChI=1/C18H21ClO/c1-13-5-10-17(16(11-13)18(2,3)4)20-12-14-6-8-15(19)9-7-14/h5-11H,12H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,9,10,11,3,15,19,16,18,4,7,13,2,14,17,6,5,8,20,12/E:(2,3,4)(6,7)(8,9)/rA:20nCCCCCCCCCCCOCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s8;s8;s5;s12;s13;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21ClO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.5798
Area:496.842
Solvation:-1.84124
Coulombic:-11.5697
Bond Count [?]
All:21
Single:15
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:288.811
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.31
LogP (Chemaxon):6.18

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