Home Other Building Blocks methyl 4-[(2-methoxy-2-oxoethyl)sulfanyl]butanoate

methyl 4-[(2-methoxy-2-oxoethyl)sulfanyl]butanoate

CAS No.:
38555-40-7
Catalog Number:
AG01AJNN
Molecular Formula:
C8H14O4S
Molecular Weight:
206.2594
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Product Description
Catalog Number:
AG01AJNN
Chemical Name:
methyl 4-[(2-methoxy-2-oxoethyl)sulfanyl]butanoate
CAS Number:
38555-40-7
Molecular Formula:
C8H14O4S
Molecular Weight:
206.2594
MDL Number:
MFCD00049017
IUPAC Name:
methyl 4-(2-methoxy-2-oxoethyl)sulfanylbutanoate
InChI:
InChI=1S/C8H14O4S/c1-11-7(9)4-3-5-13-6-8(10)12-2/h3-6H2,1-2H3
InChI Key:
FBMVQXLEJUVNRY-UHFFFAOYSA-N
SMILES:
COC(=O)CCCSCC(=O)OC
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.061g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.256g/mol
Monoisotopic Mass:
206.061g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
77.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties