Home Sulfos benzyl 2-[(chlorosulfonyl)methyl]morpholine-4-carboxylate

benzyl 2-[(chlorosulfonyl)methyl]morpholine-4-carboxylate

CAS No.:
1803584-56-6
Catalog Number:
AG01ABT7
Molecular Formula:
C13H16ClNO5S
Molecular Weight:
333.7878
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Product Description
Catalog Number:
AG01ABT7
Chemical Name:
benzyl 2-[(chlorosulfonyl)methyl]morpholine-4-carboxylate
CAS Number:
1803584-56-6
Molecular Formula:
C13H16ClNO5S
Molecular Weight:
333.7878
MDL Number:
MFCD28505645
IUPAC Name:
benzyl 2-(chlorosulfonylmethyl)morpholine-4-carboxylate
InChI:
InChI=1S/C13H16ClNO5S/c14-21(17,18)10-12-8-15(6-7-19-12)13(16)20-9-11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChI Key:
PNLZWWGBUHSCDJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCOC(C1)CS(=O)(=O)Cl)OCc1ccccc1
Properties
Complexity:
444  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.044g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.783g/mol
Monoisotopic Mass:
333.044g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties