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370-46-7

370-46-7 | 4-((Trifluoromethyl);thio);benzene-1,2-diamine

CAS No: 370-46-7 Catalog No: AG003KC8 MDL No:MFCD04973013

Product Description

Catalog Number:
AG003KC8
Chemical Name:
4-((Trifluoromethyl);thio);benzene-1,2-diamine
CAS Number:
370-46-7
Molecular Formula:
C7H7F3N2S
Molecular Weight:
208.2041
MDL Number:
MFCD04973013
IUPAC Name:
4-(trifluoromethylsulfanyl)benzene-1,2-diamine
InChI:
InChI=1S/C7H7F3N2S/c8-7(9,10)13-4-1-2-5(11)6(12)3-4/h1-3H,11-12H2
InChI Key:
XIZSGNRMTFQNEK-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1N)SC(F)(F)F

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.028g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.202g/mol
Monoisotopic Mass:
208.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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