Home Other Building Blocks tert-butyl N-(1-carbamothioylcyclopentyl)carbamate

tert-butyl N-(1-carbamothioylcyclopentyl)carbamate

CAS No.:
845643-62-1
Catalog Number:
AG019X2N
Molecular Formula:
C11H20N2O2S
Molecular Weight:
244.3537
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Product Description
Catalog Number:
AG019X2N
Chemical Name:
tert-butyl N-(1-carbamothioylcyclopentyl)carbamate
CAS Number:
845643-62-1
Molecular Formula:
C11H20N2O2S
Molecular Weight:
244.3537
MDL Number:
MFCD16665267
IUPAC Name:
tert-butyl N-(1-carbamothioylcyclopentyl)carbamate
InChI:
InChI=1S/C11H20N2O2S/c1-10(2,3)15-9(14)13-11(8(12)16)6-4-5-7-11/h4-7H2,1-3H3,(H2,12,16)(H,13,14)
InChI Key:
KZCTWESWQKGOJO-UHFFFAOYSA-N
SMILES:
O=C(NC1(CCCC1)C(=S)N)OC(C)(C)C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.125g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.353g/mol
Monoisotopic Mass:
244.125g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
96.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties