Products for Research Use Only

N-Nitrosopiperidine

CAT: 0572-TRC-N545370-500MGSize: 500 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-N545370-500MGSize:500 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
100-75-4
Synonyms
Piperidine, 1-nitroso-; 1-Nitrosopiperidine; N-Nitrosopiperidine; NPI; NPIP; NSC 138
Hazard Statement
Toxic if swallowed; UN number: UN2810; Packing Group: III
Purity
>95% (HPLC)
Smiles
O=NN1CCCCC1
Molecular Formula
C5 H10 N2 O
Molecular Weight
114.15
InChI
InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2
Additionnal Information
IUPAC name: 1-nitrosopiperidine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

N-Nitrosopiperidine

N-Nitrosopiperidine can cause cancer according to an independent committee of scientific and health experts.

CAS Number100-75-4
PubChem CID7526
IUPAC Name1-nitrosopiperidine
Molecular FormulaC5H10N2O
Molecular Weight114.15
XLogP0.4
Topological Polar Surface Area32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity78
SMILES
C1CCN(CC1)N=O
InChI
InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2
InChIKey
UWSDONTXWQOZFN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Nitrosopiperidine
CAS: 100-75-4
CID: 7526
Formula: C5H10N2O
MW: 114.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight114.15
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass114.079312947
Monoisotopic Mass114.079312947
Topological Polar Surface Area32.7 Ų
Heavy Atom Count8
Formal Charge0
Complexity78.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes