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54589-53-6 | p-Iodobenzylchloride
CAS No: 54589-53-6 Catalog No: AG00DCFD MDL No:MFCD00234271
Product Description
Catalog Number:
AG00DCFD
Chemical Name:
p-Iodobenzylchloride
CAS Number:
54589-53-6
Molecular Formula:
C7H6ClI
Molecular Weight:
252.4800
MDL Number:
MFCD00234271
IUPAC Name:
1-(chloromethyl)-4-iodobenzene
InChI:
InChI=1S/C7H6ClI/c8-5-6-1-3-7(9)4-2-6/h1-4H,5H2
InChI Key:
IACBULCMHGPEBX-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1)I
Properties
Complexity:
77
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.92g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.479g/mol
Monoisotopic Mass:
251.92g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Preparation of 1-p-halophenyl and 1-p-biphenylyl substituted monocarbadodecaborate anions [closo-1-Ar-CB11H11]- by insertion of arylhalocarbenes into [nido-B11H14]-. | Inorganic chemistry 20041213 |
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