Products for Research Use Only
RegisterLogin

Ibuprofen Piconol

CAT: 0572-TRC-I400150-250MGSize: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-I400150-250MGSize:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
64622-45-3
Synonyms
Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, 2-pyridinylmethyl ester; 2-pyridylmethyl 2-(4-isobutylphenyl)propanoate
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
CC(C)Cc1ccc(cc1)C(C)C(=O)OCc2ccccn2
Molecular Formula
C19 H23 N O2
Molecular Weight
297.39
InChI
InChI=1S/C19H23NO2/c1-14(2)12-16-7-9-17(10-8-16)15(3)19(21)22-13-18-6-4-5-11-20-18/h4-11,14-15H,12-13H2,1-3H3
Additionnal Information
IUPAC name: pyridin-2-ylmethyl 2-[4-(2-methylpropyl)phenyl]propanoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Ibuprofen Piconol

Ibuprofen piconol is an organic molecular entity.

CAS Number64622-45-3
PubChem CID3673
IUPAC Namepyridin-2-ylmethyl 2-[4-(2-methylpropyl)phenyl]propanoate
Molecular FormulaC19H23NO2
Molecular Weight297.4
XLogP4.3
Topological Polar Surface Area39.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity334
SMILES
CC(C)CC1=CC=C(C=C1)C(C)C(=O)OCC2=CC=CC=N2
InChI
InChI=1S/C19H23NO2/c1-14(2)12-16-7-9-17(10-8-16)15(3)19(21)22-13-18-6-4-5-11-20-18/h4-11,14-15H,12-13H2,1-3H3
InChIKey
ACEWLPOYLGNNHV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ibuprofen Piconol
CAS: 64622-45-3
CID: 3673
Formula: C19H23NO2
MW: 297.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight297.4
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass297.172878976
Monoisotopic Mass297.172878976
Topological Polar Surface Area39.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity334
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-H943200-100MGHydroxy Ibuprofen
TRC-H943200-10MGHydroxy Ibuprofen
TRC-I140010-100MG(S)-(+)-Ibuprofen
TRC-I140010-500MG(S)-(+)-Ibuprofen
TRC-I140040-10MGIbuprofen Dimer
TRC-I140095-1GIbuprofen Lysinate
TRC-I140000-10Grac Ibuprofen
TRC-I140040-5MGIbuprofen Dimer
TRC-I140005-500MG(R)-(-)-Ibuprofen
TRC-I140003-1MGIbuprofen-13C6

Alternative Products

CatalogName
M20754-01Ibuprofen Piconol
A18012-100Ibuprofen piconol 100mg
HY-101482R-01Ibuprofen piconol (Standard)
A18012-200Ibuprofen piconol 200mg
A18012-50Ibuprofen piconol 50mg
A18012-10mM-DIbuprofen piconol 10mM * 1mL in DMSO
RM-I210400-01Ibuprofen

Popular Products