Home Other Building Blocks 2-(isobutylthio)aniline hydrochloride

2-(isobutylthio)aniline hydrochloride

CAS No.:
861793-07-9
Catalog Number:
AG01DK5G
Molecular Formula:
C10H16ClNS
Molecular Weight:
217.7587
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DK5G
Chemical Name:
2-(isobutylthio)aniline hydrochloride
CAS Number:
861793-07-9
Molecular Formula:
C10H16ClNS
Molecular Weight:
217.7587
MDL Number:
MFCD31652535
IUPAC Name:
2-(2-methylpropylsulfanyl)aniline;hydrochloride
InChI:
InChI=1S/C10H15NS.ClH/c1-8(2)7-12-10-6-4-3-5-9(10)11;/h3-6,8H,7,11H2,1-2H3;1H
InChI Key:
KCOXQTXONBYTDT-UHFFFAOYSA-N
SMILES:
CC(CSc1ccccc1N)C.Cl
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.755g/mol
Monoisotopic Mass:
217.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties