AG00IBDC

64490-92-2 | 1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, sodium salt,dihydrate

AG00IBDC

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	64490-92-2
Catalog Number	AG00IBDC(AGN-PC-0TCPJ9)
Chemical Name	1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, sodium salt,dihydrate
IUPAC Name	sodium;2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate;dihydrate
InChI	InChI=1S/C15H15NO3.Na.2H2O/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18;;;/h3-8H,9H2,1-2H3,(H,17,18);;2*1H2/q;+1;;/p-1
InChI Key	QQILXENAYPUNEA-UHFFFAOYSA-M
MDL Number	MFCD00079607
Molecular Formula	C15H18NNaO5
Molecular Weight	315.2969
SMILES	O.O.CN1C(=CC=C1C(C1=CC=C(C=C1)C)=O)CC(=O)[O-].[Na+]
UNII	02N1TZF99F
Synonyms	Tolmetin sodium dihydrate, 64490-92-2, Sodium tolmetin dihydrate, Tolumetin sodium dihydrate, Tolmetin (sodium dihydrate), UNII-02N1TZF99F, Sodium 2-(1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl)acetate dihydrate, 02N1TZF99F, CHEBI:72014, Tolmetin sodium salt dihydrate, Sodium 1-methyl-5-p-toluoylpyrrole-2-acetate dihydrate, NCGC00017129-01, CAS-64490-92-2, 1-Methyl-5-[p-Toluoyl]Pyrrole-2 Acetic Acid, DSSTox_CID_25594, DSSTox_RID_80987, DSSTox_GSID_45594, 1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, sodium salt, dihydrate, McN-2559-21-98, Tolectin sdoium, Tolmetin sodium [USAN:USP:JAN], Tolectin (TN), 2,2-Hydroxypyrimidine, PubChem15042, Tolmetin(sodiumdihydrate), Tolmetin sodium (JAN/USP), C15H14NO3Na.2H2O, CHEMBL1437585, DTXSID5045594, HMS1570L13, HMS2097L13, HMS3714L13, BCP13056, HY-B1489, KS-00001FC3, Tox21_110792, MFCD00150761, AKOS015901743, Tox21_110792_1, API0008351, CCG-220856, CS-5160, NCGC00178815-03, AX8059532, TL8006556, FT-0649943, ST24049205, ST51015153, D00158, A834776, I14-13945, 1-METHYL-5-(P-TOLUOYL)PYRROLE-2-ACETIC ACID SODIUM SALT, DIHYDRATE, potassium 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate dihydrate, sodium [1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl]acetate--water (1/2), sodium;2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate;dihydrate, 1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, sodium salt,dihydrate, sodium 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate dihydrate, sodium 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]acetate dihydrate, 2-{1-methyl-5-[(4-methylphenyl)carbonyl]pyrrol-2-yl}acetic acid, oxamethane, o xamethane, sodium salt, Tolectin, TOLMETIN SODIUM, tolmetin, Tolmetin sodium [USAN:JAN], C15H14NNaO3.2H2O, ACN-S005378, 64490-92-2 (sodium), CID656499, C15-H14-N-O3.Na.2H2-O, 1-Methyl-5-(p-toluoyl)pyrrole-2-acetic Acid Sodium Salt dihydrate,

Complexity	353
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	315.108g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	315.301g/mol
Monoisotopic Mass	315.108g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	64.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315
Packing Group	\N
Precautionary statements	P301+P312+P330-P264-P280g-P301+P312a-P321-P332+P313-P501a
UN Code	\N

Certificate of Analysis

Lot Number