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1007536-67-5,MFCD01632291
Catalog No.:AA0002PY
1007536-67-5 | Urea, N'-(3,4-dichlorophenyl)-N,N-di(methyl-d3)-
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10mg
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$1,169.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0002PY
Chemical Name:
Urea, N'-(3,4-dichlorophenyl)-N,N-di(methyl-d3)-
CAS Number:
1007536-67-5
Molecular Formula:
C9H4Cl2D6N2O
Molecular Weight:
239.1315
MDL Number:
MFCD01632291
IUPAC Name:
3-(3,4-dichlorophenyl)-1,1-bis(trideuteriomethyl)urea
InChI:
InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)/i1D3,2D3
InChI Key:
XMTQQYYKAHVGBJ-WFGJKAKNSA-N
SMILES:
O=C(N(C([2H])([2H])[2H])C([2H])([2H])[2H])Nc1ccc(c(c1)Cl)Cl
Properties
Computed Properties
 
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.055g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
6  
Molecular Weight:
239.129g/mol
Monoisotopic Mass:
238.055g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
Diuron-d6 
1007536-67-5 
3-(3,4-Dichlorophenyl)-1,1-dimethylurea-d6 
Diuron D6 (dimethyl D6) 100 microg/mL in Acetone 
J-000216 
Urea, N'-(3,4-dichlorophenyl)-N,N-di(methyl-d3)- 
N'-(3,4-Dichlorophenyl)-N,N-bis[(~2~H_3_)methyl]urea 
[2H6]-DCMU|||[2H6]-3-(3,4-dichlorophenyl)-1,1-dimethylurea 
Diuron D6 
CS-T-53746 
Diuron-D6 (dimethyl-D6) 
3-(3,4-dichlorophenyl)-1,1-bis(trideuteriomethyl)urea 
Diuron D6 (dimethyl D6) 
CTK8F9273 
DTXSID10583576 
AKOS030243141 
FT-0667750 
Diuron-d6, PESTANAL(R), analytical standard 
Literature
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