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AG003TDW

Name: N-Tosyl-3-pyrrolecarboxylic Acid
Brand: Angene Chemical
SKU: AG003TDW

106058-86-0 | N-Tosyl-3-pyrrolecarboxylic Acid

Chemical structure of N-Tosyl-3-pyrrolecarboxylic Acid, CAS 106058-86-0

AG003TDW

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CAS Number	106058-86-0
Catalog Number	AG003TDW(AGN-PC-0KK0E9)
Chemical Name	N-Tosyl-3-pyrrolecarboxylic Acid
IUPAC Name	1-(4-methylphenyl)sulfonylpyrrole-3-carboxylic acid
InChI	InChI=1S/C12H11NO4S/c1-9-2-4-11(5-3-9)18(16,17)13-7-6-10(8-13)12(14)15/h2-8H,1H3,(H,14,15)
InChI Key	UYHPMGMXSFLPOF-UHFFFAOYSA-N
MDL Number	MFCD00145013
Molecular Formula	C12H11NO4S
Molecular Weight	265.2850
SMILES	S(=O)(=O)(C1C=CC(=CC=1)C)N1C=CC(C(O)=O)=C1
Synonyms	106058-86-0, N-Tosyl-3-pyrrolecarboxylic Acid, 1-Tosyl-1H-pyrrole-3-carboxylic acid, N-Tosyl-1H-pyrrole-3-carboxylic acid, 1-[(4-methylphenyl)sulfonyl]-1H-pyrrole-3-carboxylic acid, 1-TOSYL-PYRROLE-3-CARBOXYLIC ACID, 1-(Toluene-4-sulfonyl)-1H-pyrrole-3-carboxylic acid, 1-(4-methylbenzenesulfonyl)-1H-pyrrole-3-carboxylic acid, 1H-Pyrrole-3-carboxylic acid, 1-[(4-methylphenyl)sulfonyl]-, 1-[(4-methylphenyl)sulfonyl]pyrrole-3-carboxylic acid, 1-tosyl-1H-pyrrole-3-carboxylicacid, PubChem8355, ACMC-1CUHM, AC1MC5GZ, AC1Q2LIC, 1-(4-methylphenyl)sulfonylpyrrole-3-carboxylic Acid, SCHEMBL1504624, N-Tosyl-3-pyrrolecarboxylicAcid, CTK0H4913, KS-00000CHA, DTXSID20369207, UYHPMGMXSFLPOF-UHFFFAOYSA-N, ZINC172190, ALBB-005386, ANW-15301, CT-391, MFCD00145013, SBB047780, STK503380, AKOS005146213, AC-7298, AN-9112, LS20279, MCULE-5189403488, RTR-001223, TRA0000855, N-TOSYL-PYRRLE-3-CARBOXYLIC ACID, 1-Phenylsulfonylpyrrole-3-Carboxylic Acid, AJ-17554, AS-38512, SC-00242, SY005547, AB0053804, A2019, BB 0237691, FT-0654550, n-tosyl-3-pyrrolecarboxylic acid, AldrichCPR, ST50826013, Z6831, 1-(p-tolylsulfonyl)pyrrole-3-carboxylic acid, EN300-73409, J3.596.248D, B-6363, MFCD00145013 (97+%), 058T860, I09-0876, Q-101889, 1-(4-methylbenzenesulfonyl)pyrrole-3-carboxylic acid, 1-(Toluene-4-sulfonyl)-1H-pyrrole-3-carboxyli c acid, Z1259339899, 1H-Pyrrole-3-carboxylicacid, 1-[(4-methylphenyl)sulfonyl]-, C12H11NO4S, 1-(dimethylamino)-4-piperidinone, N-(p-Tosyl)-3-pyrrolecarboxylic acid, CID2724693,

Complexity	406
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.041g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	265.283g/mol
Monoisotopic Mass	265.041g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	84.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited