Home Carboxys 4-sulfamoylcyclohexane-1-carboxylic acid, Mixture of diastereomers

4-sulfamoylcyclohexane-1-carboxylic acid, Mixture of diastereomers

CAS No.:
1934886-10-8
Catalog Number:
AG01AKEC
Molecular Formula:
C7H13NO4S
Molecular Weight:
207.2474
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Product Description
Catalog Number:
AG01AKEC
Chemical Name:
4-sulfamoylcyclohexane-1-carboxylic acid, Mixture of diastereomers
CAS Number:
1934886-10-8
Molecular Formula:
C7H13NO4S
Molecular Weight:
207.2474
MDL Number:
MFCD30486449
IUPAC Name:
4-sulfamoylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C7H13NO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h5-6H,1-4H2,(H,9,10)(H2,8,11,12)
InChI Key:
GFKMTTKAFOHTFF-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC(CC1)S(=O)(=O)N
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.057g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.244g/mol
Monoisotopic Mass:
207.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties