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Home Carboxys tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate

tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate

CAS No.:
1625680-27-4
Catalog Number:
AG00HYRQ
Molecular Formula:
C16H26N4O4
Molecular Weight:
338.4020
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$300
- +
1g
98%
In Stock USA
United States
$750
- +
5g
98%
In Stock USA
United States
$2250
- +
Product Description
Catalog Number:
AG00HYRQ
Chemical Name:
tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate
CAS Number:
1625680-27-4
Molecular Formula:
C16H26N4O4
Molecular Weight:
338.4020
MDL Number:
MFCD29920227
IUPAC Name:
tert-butyl 4-[3-(4-nitropyrazol-1-yl)propyl]piperidine-1-carboxylate
InChI:
InChI=1S/C16H26N4O4/c1-16(2,3)24-15(21)18-9-6-13(7-10-18)5-4-8-19-12-14(11-17-19)20(22)23/h11-13H,4-10H2,1-3H3
InChI Key:
SSVHXFRUVCRCTQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)CCCn1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Properties
Complexity:
438  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.195g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.408g/mol
Monoisotopic Mass:
338.195g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties