Home Other Building Blocks 2H,3H,4H-BENZO[E]THIIN-6-YLAMINE

2H,3H,4H-BENZO[E]THIIN-6-YLAMINE

CAS No.:
1369163-28-9
Catalog Number:
AG01EI5O
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
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Product Description
Catalog Number:
AG01EI5O
Chemical Name:
2H,3H,4H-BENZO[E]THIIN-6-YLAMINE
CAS Number:
1369163-28-9
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
MDL Number:
MFCD00559309
IUPAC Name:
3,4-dihydro-2H-thiochromen-6-amine
InChI:
InChI=1S/C9H11NS/c10-8-3-4-9-7(6-8)2-1-5-11-9/h3-4,6H,1-2,5,10H2
InChI Key:
OEJAJNGQFLFIKC-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)CCCS2
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.254g/mol
Monoisotopic Mass:
165.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties