Home Aminos 1-[(3-amino-2-methylpropyl)sulfanyl]-2-methoxybenzene hydrochloride

1-[(3-amino-2-methylpropyl)sulfanyl]-2-methoxybenzene hydrochloride

CAS No.:
1258649-90-9
Catalog Number:
AG01AARO
Molecular Formula:
C11H18ClNOS
Molecular Weight:
247.7847
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Product Description
Catalog Number:
AG01AARO
Chemical Name:
1-[(3-amino-2-methylpropyl)sulfanyl]-2-methoxybenzene hydrochloride
CAS Number:
1258649-90-9
Molecular Formula:
C11H18ClNOS
Molecular Weight:
247.7847
MDL Number:
MFCD17480401
IUPAC Name:
3-(2-methoxyphenyl)sulfanyl-2-methylpropan-1-amine;hydrochloride
InChI:
InChI=1S/C11H17NOS.ClH/c1-9(7-12)8-14-11-6-4-3-5-10(11)13-2;/h3-6,9H,7-8,12H2,1-2H3;1H
InChI Key:
UNIGRHXMTSKBRS-UHFFFAOYSA-N
SMILES:
NCC(CSc1ccccc1OC)C.Cl
Properties
Complexity:
154  
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