Home Halogens 3-[(3-chlorobenzyl)thio]-1-propanamine

3-[(3-chlorobenzyl)thio]-1-propanamine

CAS No.:
1185320-24-4
Catalog Number:
AG008VMK
Molecular Formula:
C10H14ClNS
Molecular Weight:
215.7429
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG008VMK
Chemical Name:
3-[(3-chlorobenzyl)thio]-1-propanamine
CAS Number:
1185320-24-4
Molecular Formula:
C10H14ClNS
Molecular Weight:
215.7429
MDL Number:
MFCD12827472
IUPAC Name:
3-[(3-chlorophenyl)methylsulfanyl]propan-1-amine
InChI:
InChI=1S/C10H14ClNS/c11-10-4-1-3-9(7-10)8-13-6-2-5-12/h1,3-4,7H,2,5-6,8,12H2
InChI Key:
RPKSLIJHMBOHQI-UHFFFAOYSA-N
SMILES:
NCCCSCc1cccc(c1)Cl
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.739g/mol
Monoisotopic Mass:
215.054g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties