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SIMAZINE D5

CAS No.:
220621-41-0
Catalog Number:
AG00BC8U
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00BC8U
Chemical Name:
SIMAZINE D5
CAS Number:
220621-41-0
MDL Number:
MFCD01632308
IUPAC Name:
6-chloro-2-N-ethyl-4-N-(1,1,2,2,2-pentadeuterioethyl)-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)/i1D3,3D2
InChI Key:
ODCWYMIRDDJXKW-WNWXXORZSA-N
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.11g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
5  
Molecular Weight:
206.689g/mol
Monoisotopic Mass:
206.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties