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60076-09-7 | m-Iodobenzylchloride
CAS No: 60076-09-7 Catalog No: AG00EDMI MDL No:MFCD11870128
Product Description
Catalog Number:
AG00EDMI
Chemical Name:
m-Iodobenzylchloride
CAS Number:
60076-09-7
Molecular Formula:
C7H6ClI
Molecular Weight:
252.4800
MDL Number:
MFCD11870128
IUPAC Name:
1-(chloromethyl)-3-iodobenzene
InChI:
InChI=1S/C7H6ClI/c8-5-6-2-1-3-7(9)4-6/h1-4H,5H2
InChI Key:
CWGGDQMRBOFYKS-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)I
Properties
Complexity:
85
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:
3.5
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