Home Halogens 1-[(5-amino-2-chlorophenyl)sulfanyl]-N,N-dimethylformamide

1-[(5-amino-2-chlorophenyl)sulfanyl]-N,N-dimethylformamide

CAS No.:
1803606-82-7
Catalog Number:
AG01BAYL
Molecular Formula:
C9H11ClN2OS
Molecular Weight:
230.7144
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Product Description
Catalog Number:
AG01BAYL
Chemical Name:
1-[(5-amino-2-chlorophenyl)sulfanyl]-N,N-dimethylformamide
CAS Number:
1803606-82-7
Molecular Formula:
C9H11ClN2OS
Molecular Weight:
230.7144
MDL Number:
MFCD28505804
IUPAC Name:
S-(5-amino-2-chlorophenyl) N,N-dimethylcarbamothioate
InChI:
InChI=1S/C9H11ClN2OS/c1-12(2)9(13)14-8-5-6(11)3-4-7(8)10/h3-5H,11H2,1-2H3
InChI Key:
NUOHRNMZRFXIIK-UHFFFAOYSA-N
SMILES:
CN(C(=O)Sc1cc(N)ccc1Cl)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.71g/mol
Monoisotopic Mass:
230.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties