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116365-01-6 | Sulfamic acid, N-[2-[bis(2-hydroxyethyl)amino]ethyl]-, methyl ester
CAS No: 116365-01-6 Catalog No: AG000CBA MDL No:
Product Description
Catalog Number:
AG000CBA
Chemical Name:
Sulfamic acid, N-[2-[bis(2-hydroxyethyl)amino]ethyl]-, methyl ester
CAS Number:
116365-01-6
Molecular Formula:
C7H18N2O5S
Molecular Weight:
242.2932
IUPAC Name:
methyl N-[2-[bis(2-hydroxyethyl)amino]ethyl]sulfamate
InChI:
InChI=1S/C7H18N2O5S/c1-14-15(12,13)8-2-3-9(4-6-10)5-7-11/h8,10-11H,2-7H2,1H3
InChI Key:
KCMNMBFBKCSTII-UHFFFAOYSA-N
SMILES:
OCCN(CCNS(=O)(=O)OC)CCO
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
242.29g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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