Home Other Building Blocks methyl 2-methyl-3-sulfamoylbutanoate

methyl 2-methyl-3-sulfamoylbutanoate

CAS No.:
1797757-55-1
Catalog Number:
AG01A6Z8
Molecular Formula:
C6H13NO4S
Molecular Weight:
195.2367
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Product Description
Catalog Number:
AG01A6Z8
Chemical Name:
methyl 2-methyl-3-sulfamoylbutanoate
CAS Number:
1797757-55-1
Molecular Formula:
C6H13NO4S
Molecular Weight:
195.2367
MDL Number:
MFCD26935973
IUPAC Name:
methyl 2-methyl-3-sulfamoylbutanoate
InChI:
InChI=1S/C6H13NO4S/c1-4(6(8)11-3)5(2)12(7,9)10/h4-5H,1-3H3,(H2,7,9,10)
InChI Key:
ROQASPHVASFOMN-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(S(=O)(=O)N)C)C
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.057g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.233g/mol
Monoisotopic Mass:
195.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties