2-(4-Nitrophenyl)propionic acid - CAS 19910-33-9
Catalog: |
BB015374 |
Product Name: |
2-(4-Nitrophenyl)propionic acid |
CAS: |
19910-33-9 |
Synonyms: |
2-(4-nitrophenyl)propanoic acid |
IUPAC Name: | 2-(4-nitrophenyl)propanoic acid |
Description: | 2-(4-Nitrophenyl)propionic acid (CAS# 19910-33-9) is a reagent used in the preparation of α-Methylated analogs of triiodothyroalkanoic acids which have interactions with hepatic thyroid receptors. |
Molecular Weight: | 195.17 |
Molecular Formula: | C9H9NO4 |
Canonical SMILES: | CC(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)O |
InChI: | InChI=1S/C9H9NO4/c1-6(9(11)12)7-2-4-8(5-3-7)10(13)14/h2-6H,1H3,(H,11,12) |
InChI Key: | RBSRRICSXWXMRC-UHFFFAOYSA-N |
Boiling Point: | 361.9 °C at 760 mmHg |
Melting Point: | 88-89 °C (lit.) |
Purity: | 98 % |
Density: | 1.337 g/cm3 |
MDL: | MFCD00012106 |
LogP: | 2.30610 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021109952-A | Curable Adhesive Composition, Adhesive Tape, Semiconductor Wafer Processing Method, and Semiconductor Device Manufacturing Method | 20200109 |
JP-6799186-B1 | Curable Adhesive Composition, Adhesive Tape, Semiconductor Wafer Processing Method, and Semiconductor Device Manufacturing Method | 20200109 |
WO-2021018018-A1 | Degradation of bruton's tyrosine kinase (btk) by conjugation of btk inidbitors with e3 ligase ligand and methods of use | 20190726 |
WO-2020258893-A1 | A formulation of a conjugate of a tubulysin analog to a cell-binding molecule | 20190624 |
WO-2020232027-A1 | Stabilization of amines with sulfur compounds | 20190513 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.05315777 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 83.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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