Chemical ID: 6430253

CC(c1cc(ccc1O)Cl)Nc2ccc(cc2)Cl
Chemical ID:
6430253
Name [?]:
4-chloro-2-[1-(4-chlorophenyl)aminoethyl]phenol
SMILES [?]:
CC(c1cc(ccc1O)Cl)Nc2ccc(cc2)Cl
InChi [?]:
InChI=1/C14H13Cl2NO/c1-9(13-8-11(16)4-7-14(13)18)17-12-5-2-10(15)3-6-12/h2-9,17-18H,1H3
InChi Info:
AuxInfo=1/0/N:1,14,16,6,13,17,7,4,2,15,5,12,3,8,18,10,11,9/E:(2,3)(5,6)/rA:18cCCCCCCCCOClNCCCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s5;s2;s11;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13Cl2NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:9.81141
Area:470.325
Solvation:-1.94671
Coulombic:-30.4417
Bond Count [?]
All:19
Single:13
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:282.165
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:4.74
LogP (Chemaxon):4.56

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