Home Aminos ethyl 5-amino-2-(phenylsulfanyl)benzoate

ethyl 5-amino-2-(phenylsulfanyl)benzoate

CAS No.:
1308601-26-4
Catalog Number:
AG01A6LL
Molecular Formula:
C15H15NO2S
Molecular Weight:
273.3501
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Product Description
Catalog Number:
AG01A6LL
Chemical Name:
ethyl 5-amino-2-(phenylsulfanyl)benzoate
CAS Number:
1308601-26-4
Molecular Formula:
C15H15NO2S
Molecular Weight:
273.3501
MDL Number:
MFCD13343766
IUPAC Name:
ethyl 5-amino-2-phenylsulfanylbenzoate
InChI:
InChI=1S/C15H15NO2S/c1-2-18-15(17)13-10-11(16)8-9-14(13)19-12-6-4-3-5-7-12/h3-10H,2,16H2,1H3
InChI Key:
NERDZAGDSCJEKJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(N)ccc1Sc1ccccc1
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.082g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.35g/mol
Monoisotopic Mass:
273.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties