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Home Carboxys tert-Butyl 4-cyano-5,6-dihydropyridine-1(2h)-carboxylate

tert-Butyl 4-cyano-5,6-dihydropyridine-1(2h)-carboxylate

CAS No.:
873551-20-3
Catalog Number:
AG00IEHR
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$288
- +
1g
97%
1 week
United States
$719
- +
Product Description
Catalog Number:
AG00IEHR
Chemical Name:
tert-Butyl 4-cyano-5,6-dihydropyridine-1(2h)-carboxylate
CAS Number:
873551-20-3
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
MDL Number:
MFCD22665818
IUPAC Name:
tert-butyl 4-cyano-3,6-dihydro-2H-pyridine-1-carboxylate
InChI:
InChI=1S/C11H16N2O2/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13/h4H,5-7H2,1-3H3
InChI Key:
QFQAHPXXVKMPSS-UHFFFAOYSA-N
SMILES:
N#CC1=CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties