Home Carboxys tert-Butyl 4-(nitromethylene)piperidine-1-carboxylate

tert-Butyl 4-(nitromethylene)piperidine-1-carboxylate

CAS No.:
1245646-76-7
Catalog Number:
AG000MAX
Molecular Formula:
C11H18N2O4
Molecular Weight:
242.2716
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$184
- +
1g
95%
1 week
United States
$403
- +
Product Description
Catalog Number:
AG000MAX
Chemical Name:
tert-Butyl 4-(nitromethylene)piperidine-1-carboxylate
CAS Number:
1245646-76-7
Molecular Formula:
C11H18N2O4
Molecular Weight:
242.2716
MDL Number:
MFCD17677275
IUPAC Name:
tert-butyl 4-(nitromethylidene)piperidine-1-carboxylate
InChI:
InChI=1S/C11H18N2O4/c1-11(2,3)17-10(14)12-6-4-9(5-7-12)8-13(15)16/h8H,4-7H2,1-3H3
InChI Key:
RFBSOMYZEDNYCW-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(=C[N+](=O)[O-])CC1)OC(C)(C)C
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.127g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.275g/mol
Monoisotopic Mass:
242.127g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties