Home Aminos 1-[(6-aminohexyl)sulfanyl]ethan-1-one hydrochloride

1-[(6-aminohexyl)sulfanyl]ethan-1-one hydrochloride

CAS No.:
98486-87-4
Catalog Number:
AG01AD2F
Molecular Formula:
C8H18ClNOS
Molecular Weight:
211.7526
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Product Description
Catalog Number:
AG01AD2F
Chemical Name:
1-[(6-aminohexyl)sulfanyl]ethan-1-one hydrochloride
CAS Number:
98486-87-4
Molecular Formula:
C8H18ClNOS
Molecular Weight:
211.7526
MDL Number:
MFCD26936228
IUPAC Name:
S-(6-aminohexyl) ethanethioate;hydrochloride
InChI:
InChI=1S/C8H17NOS.ClH/c1-8(10)11-7-5-3-2-4-6-9;/h2-7,9H2,1H3;1H
InChI Key:
YZYAVUQEZDSMPO-UHFFFAOYSA-N
SMILES:
NCCCCCCSC(=O)C.Cl
Properties
Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.08g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.748g/mol
Monoisotopic Mass:
211.08g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties