Home Bromides 1022128-96-6
1022128-96-6,MFCD11036149
Catalog No.:AA0006V2
1022128-96-6 | 2-Bromo-6-iodobenzoic acid
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250mg
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$434.00   $304.00
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1g
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Technical Information
Catalog Number:
AA0006V2
Chemical Name:
2-Bromo-6-iodobenzoic acid
CAS Number:
1022128-96-6
Molecular Formula:
C7H4BrIO2
Molecular Weight:
326.9139
MDL Number:
MFCD11036149
IUPAC Name:
2-bromo-6-iodobenzoic acid
InChI:
InChI=1S/C7H4BrIO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)
InChI Key:
PTQGEYMPMWQTDM-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Br)cccc1I
Properties
Computed Properties
 
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.844g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
326.915g/mol
Monoisotopic Mass:
325.844g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
2-bromo-6-iodobenzoic acid 
1022128-96-6 
MFCD11036149 
RW3715 
ZINC88190261 
AKOS016014420 
ACN-025150 
CB-4116 
FCH1401354 
OR40647 
QC-3178 
RL00111 
2-?Bromo-?6-?iodo-?benzoic acid 
2-Bromo-6-iodobenzoic acid, AldrichCPR 
AK129455 
AS-41741 
DA-16614 
AB0047032 
AJ-128191 
AX8219596 
CS-0036113 
FT-0726429 
J3.633.741I 
2-BROMO-6-IODO-BENZOIC ACID 
J-508468 
SCHEMBL14661744 
Benzoic acid, 2-bromo-6-iodo- 
CTK4A0822 
DTXSID50698491 
PTQGEYMPMWQTDM-UHFFFAOYSA-N 
ZX-AT013983 
Literature
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