Home Other Building Blocks tert-butyl N-(1,1-dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)carbamate

tert-butyl N-(1,1-dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)carbamate

CAS No.:
1049148-10-8
Catalog Number:
AG01A733
Molecular Formula:
C9H15NO4S
Molecular Weight:
233.2847
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Product Description
Catalog Number:
AG01A733
Chemical Name:
tert-butyl N-(1,1-dioxo-2,3-dihydro-1lambda6-thiophen-3-yl)carbamate
CAS Number:
1049148-10-8
Molecular Formula:
C9H15NO4S
Molecular Weight:
233.2847
MDL Number:
MFCD13811953
IUPAC Name:
tert-butyl N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)carbamate
InChI:
InChI=1S/C9H15NO4S/c1-9(2,3)14-8(11)10-7-4-5-15(12,13)6-7/h4-5,7H,6H2,1-3H3,(H,10,11)
InChI Key:
YNVKZWXOINQFRR-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1C=CS(=O)(=O)C1
Properties
Complexity:
372  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.072g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.282g/mol
Monoisotopic Mass:
233.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties