AG000SD3

126208-61-5 | 1H-Pyrazol-5-amine, 3-(1,1-dimethylethyl)-1-phenyl-

AG000SD3

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CAS Number	126208-61-5
Catalog Number	AG000SD3(AGN-PC-0JW6AK)
Chemical Name	1H-Pyrazol-5-amine, 3-(1,1-dimethylethyl)-1-phenyl-
IUPAC Name	5-tert-butyl-2-phenylpyrazol-3-amine
InChI	InChI=1S/C13H17N3/c1-13(2,3)11-9-12(14)16(15-11)10-7-5-4-6-8-10/h4-9H,14H2,1-3H3
InChI Key	GFWSTBBSSBVVQP-UHFFFAOYSA-N
MDL Number	MFCD02091535
Molecular Formula	C13H17N3
Molecular Weight	215.2942
SMILES	CC(C)(C)C1=NN(C(N)=C1)C1=CC=CC=C1
Synonyms	126208-61-5, 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine, 3-(tert-Butyl)-1-phenyl-1H-pyrazol-5-amine, 5-tert-Butyl-2-phenyl-2H-pyrazol-3-ylamine, 5-tert-butyl-2-phenylpyrazol-3-amine, 5-amino-3-tert-butyl-1-phenylpyrazole, BAS 07099912, 5-tert-Butyl-2-phenyl-2H-pyrazol-3-ylamin, 5-tert-butyl-2-phenyl-pyrazol-3-amine, 1H-PYRAZOL-5-AMINE, 3-(1,1-DIMETHYLETHYL)-1-PHENYL-, ACMC-20a9ry, Enamine_005580, AC1LGGA2, SCHEMBL1264553, CTK0H3882, DTXSID00354373, GFWSTBBSSBVVQP-UHFFFAOYSA-N, HMS1409N14, ZINC252685, CS-D0006, KS-000019OK, 5170AA, ANW-63596, AR2237, CA-017, MFCD02091535, SBB095140, STK165016, 5-amino-3-t-butyl-1-phenyl-pyrazole, 5-tert-butyl-2-phenyl-3-pyrazolamine, AKOS000630119, AB10709, AN-5772, MCULE-3181867878, VZ27252, 3-t-butyl-1-phenyl-1H-pyrazol-5-amine, AJ-18396, AK-79018, AS-45304, CC-15977, SC-77983, ZB009856, 3-(tert-butyl)-1-phenylpyrazole-5-ylamine, AX8002375, BC4124235, DB-041815, RT-019796, 1-Phenyl-3-tert-butyl-1H-pyrazole-5-amine, FT-0643047, A805530, C-11515, J-005346, S14-2865, Z56917894, 3-tert-Butyl-1-phenyl-1H-pyrazol-5-amine, AldrichCPR, F8889-9232, C13H17N3, CID770634, A-8506,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.142g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.3g/mol
Monoisotopic Mass	215.142g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number