Home Carboxys methyl thiane-2-carboxylate

methyl thiane-2-carboxylate

CAS No.:
70759-78-3
Catalog Number:
AG01A5R0
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A5R0
Chemical Name:
methyl thiane-2-carboxylate
CAS Number:
70759-78-3
MDL Number:
MFCD20535181
IUPAC Name:
methyl thiane-2-carboxylate
InChI:
InChI=1S/C7H12O2S/c1-9-7(8)6-4-2-3-5-10-6/h6H,2-5H2,1H3
InChI Key:
GCUGAIGMXRQPQP-UHFFFAOYSA-N
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.056g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.231g/mol
Monoisotopic Mass:
160.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties