AG003Q3A

4815-29-6 | Ethyl 2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

AG003Q3A

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CAS Number	4815-29-6
Catalog Number	AG003Q3A(AGN-PC-0RYOOW)
Chemical Name	Ethyl 2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate
IUPAC Name	ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
InChI	InChI=1S/C10H13NO2S/c1-2-13-10(12)8-6-4-3-5-7(6)14-9(8)11/h2-5,11H2,1H3
InChI Key	BOJXCJDYZJSPMZ-UHFFFAOYSA-N
MDL Number	MFCD00102063
Molecular Formula	C10H13NO2S
Molecular Weight	211.2807
NSC Number	99004
SMILES	O=C(C1=C(N)SC2=C1CCC2)OCC
Synonyms	4815-29-6, Ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, 2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester, Ethyl 2-Amino-4H,5H,6H-Cyclopenta[B]Thiophene-3-Carboxylate, BOJXCJDYZJSPMZ-UHFFFAOYSA-N, Ethyl 2-aminocyclopenta[b]thiophene-3-carboxylate, MFCD00102063, ethyl 2-amino-5,6-dihydro-4h-cyclopenta[b]-thiophene-3-carboxylate, 4H-Cyclopenta[b]thiophene-3-carboxylic acid, 2-amino-5,6-dihydro-, ethyl ester, ethyl 2-amino-4,5,6-trihydrocyclopenta[1,2-b]thiophene-3-carboxylate, 2-AMINO-5,6-DIHYDRO-4H-CYCLOPENTA(B)THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER, NSC99004, Enamine_004067, Ethyl 2-aminocyclopentathiophene-3-carboxylate, AC1L6B4Z, AC1Q64EF, Oprea1_110819, Oprea1_176113, AC1Q336P, AC1Q336Q, ARONIS017575, CHEMBL341097, SCHEMBL1976488, CTK4J0688, KS-00001CCL, ZINC35797, DTXSID80294965, AA016, HMS1405I19, ALBB-001590, KS-000049YN, ANW-60675, BBL014356, CE-276, NSC-99004, SBB000515, STK025737, AKOS000122157, CCG-249996, CS-W015046, FS-1649, MCULE-8025077087, RP26625, TRA0032168, VT20098, AJ-08632, AK-86895, BAS 00413388, CJ-00198, SC-22561, ST005574, SY063739, ZB000970, AB0028266, DB-020453, TR-017667, FT-0625931, X0324, EN300-02303, MFCD00102063 (97%), K-9172, 815A296, AH-357/03337056, I05-2336, J-507894, Z56855769, F0016-0627, 4H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLIC ACID,2-AMIN, Ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate #, 2-amino-5,6-dihydro-4-[4h]-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester, 2-Amino-cyclopentano-[b]-thiophen-3-carboxylic acid, 5,6-dihydro-, ethyl ester, 4H-Cyclopenta[b]thiophene-3-carboxylicacid, 2-amino-5,6-dihydro-, ethyl ester, C10H13NO2S, AR-1I8291, CID264105, ethyl2-amino-5,6-dihydro-4h-cyclopenta[b]-thiophene-3-carboxylate, 2-AMINO-5,6-DIHYDRO-4H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLICACIDETHYLESTER, Ethyl 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, 97% - 1G 1g, 491-31-6,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.067g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	211.279g/mol
Monoisotopic Mass	211.067g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	80.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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