AG001M8V

15001-08-8 | 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(3-chlorophenyl)-, ethyl ester

AG001M8V

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CAS Number	15001-08-8
Catalog Number	AG001M8V(AGN-PC-0JVZFF)
Chemical Name	1H-Pyrazole-4-carboxylic acid, 5-amino-1-(3-chlorophenyl)-, ethyl ester
IUPAC Name	ethyl 5-amino-1-(3-chlorophenyl)pyrazole-4-carboxylate
InChI	InChI=1S/C12H12ClN3O2/c1-2-18-12(17)10-7-15-16(11(10)14)9-5-3-4-8(13)6-9/h3-7H,2,14H2,1H3
InChI Key	CQYOTMSWCKDYTD-UHFFFAOYSA-N
MDL Number	MFCD00973940
Molecular Formula	C12H12ClN3O2
Molecular Weight	265.6956
SMILES	O=C(C1=C(N)N(C2=CC=CC(Cl)=C2)N=C1)OCC
Synonyms	ethyl 5-amino-1-(3-chlorophenyl)-1h-pyrazole-4-carboxylate, 15001-08-8, MLS000056973, ethyl 5-amino-1-(3-chlorophenyl)pyrazole-4-carboxylate, SMR000064008, CQYOTMSWCKDYTD-UHFFFAOYSA-N, AC1LFP2D, AC1Q3OXD, AC1Q332K, cid_757292, CHEMBL1452615, SCHEMBL10340638, BDBM49034, CTK4C6476, KS-00001NDJ, DTXSID90353890, HMS2422D07, ZINC215737, 4637AD, CCG-34103, MFCD00973940, SBB040511, AKOS000260138, ACN-000067, ethylaminochlorophenylpyrazolecarboxylate, MCULE-6989422838, QC-4462, RP14935, AJ-17979, ZB009554, DB-063841, TR-006108, EU-0029352, FT-0680405, EN300-10285, A-8332, 4W-0290, SR-01000575228, SR-01000575228-1, I14-13506, ethyl 5-azanyl-1-(3-chlorophenyl)pyrazole-4-carboxylate, F2199-0570, 5-amino-1-(3-chlorophenyl)-4-pyrazolecarboxylic acid ethyl ester, 5-amino-1-(3-chlorophenyl)pyrazole-4-carboxylic acid ethyl ester, 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(3-chlorophenyl)-, ethyl ester, 1H-Pyrazole-4-carboxylicacid, 5-amino-1-(3-chlorophenyl)-, ethyl ester, 5-amino-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylic acid, ethyl ester, C12H12ClN3O2, AR-1I9399, CID757292, Ethyl5-amino-1-(3-chlorophenyl)-1H-pyrazole-4-carboxylate, 1504-63-8,

Complexity	303
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.062g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	265.697g/mol
Monoisotopic Mass	265.062g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	70.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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