Home Other Building Blocks 1-{4-[(2-methoxyethyl)sulfanyl]phenyl}ethan-1-amine hydrochloride

1-{4-[(2-methoxyethyl)sulfanyl]phenyl}ethan-1-amine hydrochloride

CAS No.:
1258650-79-1
Catalog Number:
AG01AB20
Molecular Formula:
C11H18ClNOS
Molecular Weight:
247.7847
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Product Description
Catalog Number:
AG01AB20
Chemical Name:
1-{4-[(2-methoxyethyl)sulfanyl]phenyl}ethan-1-amine hydrochloride
CAS Number:
1258650-79-1
Molecular Formula:
C11H18ClNOS
Molecular Weight:
247.7847
MDL Number:
MFCD17977033
IUPAC Name:
1-[4-(2-methoxyethylsulfanyl)phenyl]ethanamine;hydrochloride
InChI:
InChI=1S/C11H17NOS.ClH/c1-9(12)10-3-5-11(6-4-10)14-8-7-13-2;/h3-6,9H,7-8,12H2,1-2H3;1H
InChI Key:
VZYZYXIWRIALLO-UHFFFAOYSA-N
SMILES:
COCCSc1ccc(cc1)C(N)C.Cl
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.781g/mol
Monoisotopic Mass:
247.08g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties