Home Carboxys tert-butyl 4-nitrosopiperazine-1-carboxylate

tert-butyl 4-nitrosopiperazine-1-carboxylate

CAS No.:
877177-42-9
Catalog Number:
AG00H3XP
Molecular Formula:
C9H17N3O3
Molecular Weight:
215.2496
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Product Description
Catalog Number:
AG00H3XP
Chemical Name:
tert-butyl 4-nitrosopiperazine-1-carboxylate
CAS Number:
877177-42-9
Molecular Formula:
C9H17N3O3
Molecular Weight:
215.2496
MDL Number:
MFCD16990498
IUPAC Name:
tert-butyl 4-nitrosopiperazine-1-carboxylate
InChI:
InChI=1S/C9H17N3O3/c1-9(2,3)15-8(13)11-4-6-12(10-14)7-5-11/h4-7H2,1-3H3
InChI Key:
JSDOTLMZJULKCP-UHFFFAOYSA-N
SMILES:
O=NN1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.127g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.253g/mol
Monoisotopic Mass:
215.127g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties