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88218-54-6 | Naphthalene, 1-(2,3,3-trichloro-2-propenyl)-
CAS No: 88218-54-6 Catalog No: AG004BQJ MDL No:
Product Description
Catalog Number:
AG004BQJ
Chemical Name:
Naphthalene, 1-(2,3,3-trichloro-2-propenyl)-
CAS Number:
88218-54-6
Molecular Formula:
C13H9Cl3
Molecular Weight:
271.5696
IUPAC Name:
1-(2,3,3-trichloroprop-2-enyl)naphthalene
InChI:
InChI=1S/C13H9Cl3/c14-12(13(15)16)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2
InChI Key:
UAQQPHLDDOUXRF-UHFFFAOYSA-N
SMILES:
ClC(=C(Cc1cccc2c1cccc2)Cl)Cl
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.977g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.565g/mol
Monoisotopic Mass:
269.977g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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