Home Other Building Blocks 2-methoxy-4-(methylsulfanyl)aniline hydrochloride

2-methoxy-4-(methylsulfanyl)aniline hydrochloride

CAS No.:
1657-82-5
Catalog Number:
AG01BF3T
Molecular Formula:
C8H12ClNOS
Molecular Weight:
205.7050
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Product Description
Catalog Number:
AG01BF3T
Chemical Name:
2-methoxy-4-(methylsulfanyl)aniline hydrochloride
CAS Number:
1657-82-5
Molecular Formula:
C8H12ClNOS
Molecular Weight:
205.7050
MDL Number:
MFCD22054917
IUPAC Name:
2-methoxy-4-methylsulfanylaniline;hydrochloride
InChI:
InChI=1S/C8H11NOS.ClH/c1-10-8-5-6(11-2)3-4-7(8)9;/h3-5H,9H2,1-2H3;1H
InChI Key:
MFSQQZUMFMDTAP-UHFFFAOYSA-N
SMILES:
COc1cc(SC)ccc1N.Cl
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.7g/mol
Monoisotopic Mass:
205.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties