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182056-39-9 | Benzene, 2-bromo-4-iodo-1-methoxy-
CAS No: 182056-39-9 Catalog No: AG0023B9 MDL No:MFCD03425935
Product Description
Catalog Number:
AG0023B9
Chemical Name:
Benzene, 2-bromo-4-iodo-1-methoxy-
CAS Number:
182056-39-9
Molecular Formula:
C7H6BrIO
Molecular Weight:
312.9304
MDL Number:
MFCD03425935
IUPAC Name:
2-bromo-4-iodo-1-methoxybenzene
InChI:
InChI=1S/C7H6BrIO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3
InChI Key:
YIQMMXVWWSWNGR-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Br)I
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.865g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.932g/mol
Monoisotopic Mass:
311.865g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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