Home Other Building Blocks 4-(methylsulfanyl)azepane

4-(methylsulfanyl)azepane

CAS No.:
1695807-83-0
Catalog Number:
AG01BHA2
Molecular Formula:
C7H15NS
Molecular Weight:
145.2657
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Product Description
Catalog Number:
AG01BHA2
Chemical Name:
4-(methylsulfanyl)azepane
CAS Number:
1695807-83-0
Molecular Formula:
C7H15NS
Molecular Weight:
145.2657
MDL Number:
MFCD28246255
IUPAC Name:
4-methylsulfanylazepane
InChI:
InChI=1S/C7H15NS/c1-9-7-3-2-5-8-6-4-7/h7-8H,2-6H2,1H3
InChI Key:
AJGCARNEWLWAPY-UHFFFAOYSA-N
SMILES:
CSC1CCNCCC1
Properties
Complexity:
75.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.093g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
145.264g/mol
Monoisotopic Mass:
145.093g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties