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4-cyclohexylphenyl (2E)-3-(3-nitrophenyl)prop-2-enoate

4-cyclohexylphenyl (2E)-3-(3-nitrophenyl)prop-2-enoate

Formula: C21H21NO4

SMILES: [O-][N+](=O)C1=CC(C=CC(=O)OC2=CC=C(C=C2)C2CCCCC2)=CC=C1

IUPAC: 4-cyclohexylphenyl (2E)-3-(3-nitrophenyl)prop-2-enoate

InChI: InChI=1S/C21H21NO4/c23-21(14-9-16-5-4-8-19(15-16)22(24)25)26-20-12-10-18(11-13-20)17-6-2-1-3-7-17/h4-5,8-15,17H,1-3,6-7H2/b14-9+

Composition: C (71.78%), H (6.02%), N (3.99%), O (18.21%)

Molar Mass: 351.402

Atom Count: 47

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 351.14705816
Formal Charge 0
FSP3 0.29
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey MGBUSBSAVVUIMY-NTEUORMPSA-N
Lipinski's Rule of Five
Molar Refractivity 100.12
Topological Polar Surface Area 69.44
Polarizability 38.04
Ring Count 3
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H21NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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