Text Search
Structure Search

N-[(4-nitrophenyl)methyl]cycloheptanamine

N-[(4-nitrophenyl)methyl]cycloheptanamine

Formula: C14H20N2O2

SMILES: [O-][N+](=O)C1=CC=C(CNC2CCCCCC2)C=C1

IUPAC: N-[(4-nitrophenyl)methyl]cycloheptanamine

InChI: InChI=1S/C14H20N2O2/c17-16(18)14-9-7-12(8-10-14)11-15-13-5-3-1-2-4-6-13/h7-10,13,15H,1-6,11H2

Composition: C (67.72%), H (8.12%), N (11.28%), O (12.89%)

Molar Mass: 248.326

Atom Count: 38

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 248.152477892
Formal Charge 0
FSP3 0.57
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey JIFJLALKYPETLR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.24
Topological Polar Surface Area 55.17
Polarizability 27.71
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H20N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote