Home Carboxys tert-Butyl 3-cyano-2,5-dihydropyrrole-1-carboxylate

tert-Butyl 3-cyano-2,5-dihydropyrrole-1-carboxylate

CAS No.:
1353629-54-5
Catalog Number:
AG00HU1L
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$275
- +
1g
97%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00HU1L
Chemical Name:
tert-Butyl 3-cyano-2,5-dihydropyrrole-1-carboxylate
CAS Number:
1353629-54-5
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD29035366
IUPAC Name:
tert-butyl 3-cyano-2,5-dihydropyrrole-1-carboxylate
InChI:
InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h4H,5,7H2,1-3H3
InChI Key:
BPSATPNFHCGTPJ-UHFFFAOYSA-N
SMILES:
N#CC1=CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties