Home Other Building Blocks tert-butyl N-(1,2,5-thiadiazol-3-yl)carbamate

tert-butyl N-(1,2,5-thiadiazol-3-yl)carbamate

CAS No.:
152513-86-5
Catalog Number:
AG019TXA
Molecular Formula:
C7H11N3O2S
Molecular Weight:
201.2461
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Product Description
Catalog Number:
AG019TXA
Chemical Name:
tert-butyl N-(1,2,5-thiadiazol-3-yl)carbamate
CAS Number:
152513-86-5
Molecular Formula:
C7H11N3O2S
Molecular Weight:
201.2461
MDL Number:
MFCD22378808
IUPAC Name:
tert-butyl N-(1,2,5-thiadiazol-3-yl)carbamate
InChI:
InChI=1S/C7H11N3O2S/c1-7(2,3)12-6(11)9-5-4-8-13-10-5/h4H,1-3H3,(H,9,10,11)
InChI Key:
UEFQUHGWYWICLL-UHFFFAOYSA-N
SMILES:
O=C(Nc1cnsn1)OC(C)(C)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.057g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.244g/mol
Monoisotopic Mass:
201.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties