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5460-32-2 | 3,4-DIMETHOXYIODOBENZENE
CAS No: 5460-32-2 Catalog No: AG00DBPQ MDL No:MFCD00094416
Product Description
Catalog Number:
AG00DBPQ
Chemical Name:
3,4-DIMETHOXYIODOBENZENE
CAS Number:
5460-32-2
Molecular Formula:
C8H9IO2
Molecular Weight:
264.0603
MDL Number:
MFCD00094416
IUPAC Name:
4-iodo-1,2-dimethoxybenzene
InChI:
InChI=1S/C8H9IO2/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5H,1-2H3
InChI Key:
PUCISUQLWLKKJH-UHFFFAOYSA-N
SMILES:
COc1cc(I)ccc1OC
NSC Number:
25012
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.965g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.062g/mol
Monoisotopic Mass:
263.965g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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