Home Other Building Blocks ethyl 2-[(ethoxymethanethioyl)sulfanyl]-2-fluoroacetate

ethyl 2-[(ethoxymethanethioyl)sulfanyl]-2-fluoroacetate

CAS No.:
883857-57-6
Catalog Number:
AG01BG41
Molecular Formula:
C7H11FO3S2
Molecular Weight:
226.2888
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Product Description
Catalog Number:
AG01BG41
Chemical Name:
ethyl 2-[(ethoxymethanethioyl)sulfanyl]-2-fluoroacetate
CAS Number:
883857-57-6
Molecular Formula:
C7H11FO3S2
Molecular Weight:
226.2888
MDL Number:
MFCD28125043
IUPAC Name:
ethyl 2-ethoxycarbothioylsulfanyl-2-fluoroacetate
InChI:
InChI=1S/C7H11FO3S2/c1-3-10-6(9)5(8)13-7(12)11-4-2/h5H,3-4H2,1-2H3
InChI Key:
BORPAFBPTFAEQP-UHFFFAOYSA-N
SMILES:
CCOC(=S)SC(C(=O)OCC)F
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.28g/mol
Monoisotopic Mass:
226.013g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties