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84039-00-9 | Bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene, 2-(chloromethyl)-
CAS No: 84039-00-9 Catalog No: AG0050L8 MDL No:
Product Description
Catalog Number:
AG0050L8
Chemical Name:
Bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene, 2-(chloromethyl)-
CAS Number:
84039-00-9
Molecular Formula:
C12H11Cl
Molecular Weight:
190.6687
IUPAC Name:
2-(chloromethyl)bicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaene
InChI:
InChI=1S/C12H11Cl/c13-9-12-7-3-5-10-4-1-2-6-11(12)8-10/h1-7H,8-9H2
InChI Key:
FTXXDYGODPYRLB-UHFFFAOYSA-N
SMILES:
ClCc1cccc2Cc1cccc2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.67g/mol
Monoisotopic Mass:
190.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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