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5331-87-3,MFCD00059591
Catalog No.:AA003I9Y
5331-87-3 | 3,3'-Dichlorodiphenyl 4,4'-diisocyanate
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25g
>95.0%(T)
1 week  
$803.00   $562.00
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Technical Information
Catalog Number:
AA003I9Y
Chemical Name:
3,3'-Dichlorodiphenyl 4,4'-diisocyanate
CAS Number:
5331-87-3
MDL Number:
MFCD00059591
IUPAC Name:
2-chloro-4-(3-chloro-4-isocyanatophenyl)-1-isocyanatobenzene
InChI:
InChI=1S/C14H6Cl2N2O2/c15-11-5-9(1-3-13(11)17-7-19)10-2-4-14(18-8-20)12(16)6-10/h1-6H
InChI Key:
JITXMLLVGWGFGV-UHFFFAOYSA-N
NSC Number:
2338
Properties
Computed Properties
 
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.981g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.114g/mol
Monoisotopic Mass:
303.981g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4  

Synonyms
 
5331-87-3 
3,3'-Dichloro-4,4'-diisocyanatobiphenyl 
CTK4J7584 
DTXSID20277434 
NSC-2338 
ZINC1640848 
ANW-31703 
MFCD00059591 
3,3'-Dichlorobiphenyl 4,4'-Diisocyanate 
TC-120448 
D1541 
FT-0712052 
3,3'-Dichlorodiphenyl 4,4'-Diisocyanate 
3,3'-Dichlorobiphenyl-4,4'-diyl Diisocyanate 
3,3'-Dichloro-4,4'-diisocyanato-1,1'-biphenyl 
A829508 
C-44448 
1,1'-Biphenyl,3,3'-dichloro-4,4'-diisocyanato- 
I14-60113 
3,3'-Dichloro-4,4'-diisocyanato-1,1'-biphenyl, AldrichCPR 
2-chloranyl-4-(3-chloranyl-4-isocyanato-phenyl)-1-isocyanato-benzene 
AR-1E8633 
CID220082 
2-chloro-4-(3-chloro-4-isocyanatophenyl)-1-isocyanatobenzene 
3,3'-DICHLORODIPHENYL4,4'-DIISOCYANATE 
58089-99-9 
NSC2338 
AC1Q3M4U 
SCHEMBL277940 
ACMC-209l61 
AC1L584X 
3,4'-ISOCYANATOBIPHENYL 
Literature
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