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1443336-33-1

1443336-33-1 | 4-[(Di-n-propylamino)methyl]thiophenol

CAS No: 1443336-33-1 Catalog No: AG01FCRD MDL No:

Product Description

Catalog Number:
AG01FCRD
Chemical Name:
4-[(Di-n-propylamino)methyl]thiophenol
CAS Number:
1443336-33-1
Molecular Formula:
C13H21NS
Molecular Weight:
223.3775
IUPAC Name:
4-[(dipropylamino)methyl]benzenethiol
InChI:
InChI=1S/C13H21NS/c1-3-9-14(10-4-2)11-12-5-7-13(15)8-6-12/h5-8,15H,3-4,9-11H2,1-2H3
InChI Key:
UZENIIDBNVSNAC-UHFFFAOYSA-N
SMILES:
CCCN(Cc1ccc(cc1)S)CCC

Properties

Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.139g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.378g/mol
Monoisotopic Mass:
223.139g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
4.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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