Home Sulfos tert-butyl N-[4-(ethoxysulfonyl)but-3-en-2-yl]carbamate

tert-butyl N-[4-(ethoxysulfonyl)but-3-en-2-yl]carbamate

CAS No.:
1824685-77-9
Catalog Number:
AG01C4XN
Molecular Formula:
C11H21NO5S
Molecular Weight:
279.3531
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Product Description
Catalog Number:
AG01C4XN
Chemical Name:
tert-butyl N-[4-(ethoxysulfonyl)but-3-en-2-yl]carbamate
CAS Number:
1824685-77-9
Molecular Formula:
C11H21NO5S
Molecular Weight:
279.3531
MDL Number:
MFCD24542110
IUPAC Name:
ethyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]but-1-ene-1-sulfonate
InChI:
InChI=1S/C11H21NO5S/c1-6-16-18(14,15)8-7-9(2)12-10(13)17-11(3,4)5/h7-9H,6H2,1-5H3,(H,12,13)
InChI Key:
VRWUAFNFOUSVPJ-UHFFFAOYSA-N
SMILES:
CCOS(=O)(=O)C=CC(NC(=O)OC(C)(C)C)C
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.114g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.351g/mol
Monoisotopic Mass:
279.114g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
90.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.3  
Properties