AG00BC38

2458-26-6 | 3-Phenyl-1H-pyrazole

AG00BC38

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CAS Number	2458-26-6
Catalog Number	AG00BC38(AGN-PC-0O87CU)
Chemical Name	3-Phenyl-1H-pyrazole
IUPAC Name	5-phenyl-1H-pyrazole
InChI	InChI=1S/C9H8N2/c1-2-4-8(5-3-1)9-6-7-10-11-9/h1-7H,(H,10,11)
InChI Key	OEDUIFSDODUDRK-UHFFFAOYSA-N
MDL Number	MFCD00159654
Molecular Formula	C9H8N2
Molecular Weight	144.1732
SMILES	c1(cc[nH]n1)c1ccccc1
Synonyms	3-Phenyl-1H-pyrazole, 2458-26-6, 3-Phenylpyrazole, 5-phenyl-1H-pyrazole, 1H-Pyrazole, 3-phenyl-, 3-benzylpyrazole, PYRAZOLE, 3-PHENYL-, 3-Phenylpyrazol, phenylpyrazole, CHEMBL38876, OEDUIFSDODUDRK-UHFFFAOYSA-N, 3(5)-Phenyl-1H-pyrazole, 99+%, 3(5)-phenyl-1h-pyrazole, 5-phenylpyrazole, InChI=1/C9H8N2/c1-2-4-8(5-3-1)9-6-7-10-11-9/h1-7H,(H,10,11, 3-phenyl-pyrazole, 3-Phenyl pyrazole, MFCD00159654, 3(5)-phenylpyrazole, 3-phenyl-2H-pyrazole, PubChem10422, 3-Phenyl-1H-pyrazole #, AC1L29FK, AC1Q4W0G, SCHEMBL9438, KSC201S1N, 3-Phenyl-1H-pyrazole, 97%, Jsp004909, CTK1A1916, DTXSID40179320, ACT06758, ALBB-005415, BCP25611, KS-00000NP6, ZINC9238252, ANW-25482, BBL012454, BDBM50078831, CL3440, SBB023350, STK097634, AKOS000313117, AKOS000345348, ACN-000345, AM80878, AS-5622, CS-W002461, LS20162, MCULE-9865969061, QC-4492, RD-0203, VP20088, NCGC00331164-01, AC-23138, AJ-59405, AK-39279, AN-50951, SC-81108, SY009071, AB0003395, AJ-138353, DB-011228, LS-128552, ST2405179, 4CH-001848, A5050, BB 0237722, FT-0616352, P2063, ST50681581, EN300-62492, MFCD00159654 (97%), Y-9188, 12707-EP2274983A1, 12707-EP2295402A2, 12707-EP2308858A1, 12707-EP2311816A1, 12707-EP2311817A1, 12707-EP2316831A1, 12707-EP2374791A1, AB01205810-03, J-513034, J-640158, J-800161, S14-2003, I14-10995, F1667-0020, Z1224534135, 3-benzyl-1H-pyrazole, 5-Amino-3-phenylpyrazole, 4-Antipyrine carboxaldehyde, C9-H8-N2, CID17155, ZINC00152284,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.069g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	144.177g/mol
Monoisotopic Mass	144.069g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number