Home Other Building Blocks 1,4-dithian-2-ylmethanamine

1,4-dithian-2-ylmethanamine

CAS No.:
15980-17-3
Catalog Number:
AG019YTG
Molecular Formula:
C5H11NS2
Molecular Weight:
149.2775
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Product Description
Catalog Number:
AG019YTG
Chemical Name:
1,4-dithian-2-ylmethanamine
CAS Number:
15980-17-3
Molecular Formula:
C5H11NS2
Molecular Weight:
149.2775
MDL Number:
MFCD06213288
IUPAC Name:
1,4-dithian-2-ylmethanamine
InChI:
InChI=1S/C5H11NS2/c6-3-5-4-7-1-2-8-5/h5H,1-4,6H2
InChI Key:
HZTQIHOZXLWKKI-UHFFFAOYSA-N
SMILES:
NCC1CSCCS1
Properties
Complexity:
67.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.033g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.27g/mol
Monoisotopic Mass:
149.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties