Home Other Building Blocks 4-[(2-methoxyethyl)sulfanyl]aniline

4-[(2-methoxyethyl)sulfanyl]aniline

CAS No.:
1095599-55-5
Catalog Number:
AG01AHXT
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
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Product Description
Catalog Number:
AG01AHXT
Chemical Name:
4-[(2-methoxyethyl)sulfanyl]aniline
CAS Number:
1095599-55-5
Molecular Formula:
C9H13NOS
Molecular Weight:
183.2706
MDL Number:
MFCD11635172
IUPAC Name:
4-(2-methoxyethylsulfanyl)aniline
InChI:
InChI=1S/C9H13NOS/c1-11-6-7-12-9-4-2-8(10)3-5-9/h2-5H,6-7,10H2,1H3
InChI Key:
MXBPRIALOVTHRD-UHFFFAOYSA-N
SMILES:
COCCSc1ccc(cc1)N
Properties
Complexity:
113  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.072g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.269g/mol
Monoisotopic Mass:
183.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties