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Home > Bromides > 1263377-40-7
1263377-40-7 | 1-?Bromo-?2-?chloro-?5-?iodo-?3-?methoxy-benzene
CAS No: 1263377-40-7 Catalog No: AG01ERKG MDL No:MFCD18089326
Product Description
Catalog Number:
AG01ERKG
Chemical Name:
1-?Bromo-?2-?chloro-?5-?iodo-?3-?methoxy-benzene
CAS Number:
1263377-40-7
Molecular Formula:
C7H5BrClIO
Molecular Weight:
347.3755
MDL Number:
MFCD18089326
IUPAC Name:
1-bromo-2-chloro-5-iodo-3-methoxybenzene
InChI:
InChI=1S/C7H5BrClIO/c1-11-6-3-4(10)2-5(8)7(6)9/h2-3H,1H3
InChI Key:
GOVVRCZPILNXFE-UHFFFAOYSA-N
SMILES:
COc1cc(I)cc(c1Cl)Br
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.826g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.374g/mol
Monoisotopic Mass:
345.826g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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