Home Other Building Blocks tert-butyl N-[(1,1-dioxo-1lambda6-thian-2-yl)methyl]carbamate

tert-butyl N-[(1,1-dioxo-1lambda6-thian-2-yl)methyl]carbamate

CAS No.:
1461708-19-9
Catalog Number:
AG01A5R2
Molecular Formula:
C11H21NO4S
Molecular Weight:
263.3537
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Product Description
Catalog Number:
AG01A5R2
Chemical Name:
tert-butyl N-[(1,1-dioxo-1lambda6-thian-2-yl)methyl]carbamate
CAS Number:
1461708-19-9
Molecular Formula:
C11H21NO4S
Molecular Weight:
263.3537
MDL Number:
MFCD25371615
IUPAC Name:
tert-butyl N-[(1,1-dioxothian-2-yl)methyl]carbamate
InChI:
InChI=1S/C11H21NO4S/c1-11(2,3)16-10(13)12-8-9-6-4-5-7-17(9,14)15/h9H,4-8H2,1-3H3,(H,12,13)
InChI Key:
BXRBLVJZUOBNMB-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC1CCCCS1(=O)=O
Properties
Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.119g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.352g/mol
Monoisotopic Mass:
263.119g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties