Chemical ID: 4588408

c1ccc2c(c1)C=CC2=Cc3ccc(cc3Cl)Cl
Chemical ID:
4588408
Name [?]:
1-[(2,4-dichlorophenyl)methylene]indene
SMILES [?]:
c1ccc2c(c1)C=CC2=Cc3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C16H10Cl2/c17-14-8-7-13(16(18)10-14)9-12-6-5-11-3-1-2-4-15(11)12/h1-10H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,7,8,12,13,10,15,5,9,11,14,4,16,18,17/rA:18nCCCCCCCCCCCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;w9;s10;s11;d12;s13;d14;d11s15;s16;s14;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H10Cl2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:10.0965
Area:438.73
Solvation:-0.871737
Coulombic:-4.97382
Bond Count [?]
All:20
Single:12
Double:8
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:273.156
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:6.22
LogP (Chemaxon):5.16

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Descriptor Annotations

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