Home Other Building Blocks 4-(tert-butylsulfanyl)-3-fluoroaniline

4-(tert-butylsulfanyl)-3-fluoroaniline

CAS No.:
1039335-62-0
Catalog Number:
AG01AUBV
Molecular Formula:
C10H14FNS
Molecular Weight:
199.2883
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Product Description
Catalog Number:
AG01AUBV
Chemical Name:
4-(tert-butylsulfanyl)-3-fluoroaniline
CAS Number:
1039335-62-0
Molecular Formula:
C10H14FNS
Molecular Weight:
199.2883
MDL Number:
MFCD11193356
IUPAC Name:
4-tert-butylsulfanyl-3-fluoroaniline
InChI:
InChI=1S/C10H14FNS/c1-10(2,3)13-9-5-4-7(12)6-8(9)11/h4-6H,12H2,1-3H3
InChI Key:
LGRLBZUSPANJLX-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)F)SC(C)(C)C
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.083g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.287g/mol
Monoisotopic Mass:
199.083g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties