Home Other Building Blocks tert-butyl N-(1,2-dithiolan-4-yl)carbamate

tert-butyl N-(1,2-dithiolan-4-yl)carbamate

CAS No.:
1053178-96-3
Catalog Number:
AG01AKML
Molecular Formula:
C8H15NO2S2
Molecular Weight:
221.3402
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Product Description
Catalog Number:
AG01AKML
Chemical Name:
tert-butyl N-(1,2-dithiolan-4-yl)carbamate
CAS Number:
1053178-96-3
Molecular Formula:
C8H15NO2S2
Molecular Weight:
221.3402
MDL Number:
MFCD19982618
IUPAC Name:
tert-butyl N-(dithiolan-4-yl)carbamate
InChI:
InChI=1S/C8H15NO2S2/c1-8(2,3)11-7(10)9-6-4-12-13-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChI Key:
QSZSBFIOTUHZKI-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CSSC1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.333g/mol
Monoisotopic Mass:
221.054g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties