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115860-69-0 | Benzoyl chloride, 5-iodo-2-methoxy-
CAS No: 115860-69-0 Catalog No: AG000GZP MDL No:
Product Description
Catalog Number:
AG000GZP
Chemical Name:
Benzoyl chloride, 5-iodo-2-methoxy-
CAS Number:
115860-69-0
Molecular Formula:
C8H6ClIO2
Molecular Weight:
296.4895
IUPAC Name:
5-iodo-2-methoxybenzoyl chloride
InChI:
InChI=1S/C8H6ClIO2/c1-12-7-3-2-5(10)4-6(7)8(9)11/h2-4H,1H3
InChI Key:
CDYVIRSFYCLQTM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)Cl)I
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.91g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.488g/mol
Monoisotopic Mass:
295.91g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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