tert-butyl N-(2-cyanopyrrol-1-yl)carbamate


Chemical Name: tert-butyl N-(2-cyanopyrrol-1-yl)carbamate
CAS Number: 937046-96-3
Product Number: AG00GZPK(AGN-PC-08XZW7)
Synonyms:
MDL No:
Molecular Formula: C10H13N3O2
Molecular Weight: 207.2291

Identification/Properties


Computed Properties
Molecular Weight:
207.233g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
207.101g/mol
Monoisotopic Mass:
207.101g/mol
Topological Polar Surface Area:
67A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
287
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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