Mefenamic acid EP Impurity C - CAS 118-91-2

Name: Mefenamic acid EP Impurity C
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB004340
Product Name:	Mefenamic acid EP Impurity C
CAS:	118-91-2
Synonyms:	Benzoic acid, 2-chloro-; Benzoic acid, o-chloro-

Technical Data

IUPAC Name:	2-chlorobenzoic acid
Description:	An impurity of Mefenamic acid, a nonsteroidal anti-inflammatory drug (NSAID) used to treat mild to moderate pain.
Molecular Weight:	156.57
Molecular Formula:	C7H5ClO2
Canonical SMILES:	C1=CC=C(C(=C1)C(=O)O)Cl
InChI:	InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)
InChI Key:	IKCLCGXPQILATA-UHFFFAOYSA-N
Boiling Point:	285 °C
Melting Point:	139-144 °C
Flash Point:	173°C
Purity:	> 95 %
Density:	1.544 g/cm³
Solubility:	less than 1 mg/mL at 68 °F
Appearance:	White solid
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00002412
LogP:	2.03820
Stability:	Stable, combustible. Incompatible with strong bases, strong oxidizing agents.
Vapor Pressure:	0.00242mmHg at 25°C

GHS Hazard Statement:	H302 (29.82%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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US-10988479-B1	Morphic forms of trilaciclib and methods of manufacture thereof	20200615
EP-3838345-A1	Macrocyclic peptides	20191220
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WO-2021123050-A1	Retro-inverso peptides	20191220

PMID	Publication Date	Title	Journal
25173999	20141001	An allosteric modulator to control endogenous G protein-coupled receptors with light	Nature chemical biology
22443185	20120323	Bioaugmentation of a historically contaminated soil by polychlorinated biphenyls with Lentinus tigrinus	Microbial cell factories
22300252	20120302	Assembly of 3-substituted isocoumarins via a CuI-catalyzed domino coupling/addition/deacylation process	The Journal of organic chemistry
21870046	20120301	Degradation of 2-chlorotoluene by Rhodococcus sp. OCT 10	Applied microbiology and biotechnology
22346916	20120201	N-(2-Chloro-benzo-yl)-2-nitro-benzene-sulfonamide	Acta crystallographica. Section E, Structure reports online

Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	155.9978071
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	155.9978071
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1