AG002Q4Q

24994-04-5 | 2H-Tetrazole, 5-(4-methylphenyl)-

AG002Q4Q

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CAS Number	24994-04-5
Catalog Number	AG002Q4Q(AGN-PC-0O88MY)
Chemical Name	2H-Tetrazole, 5-(4-methylphenyl)-
IUPAC Name	5-(4-methylphenyl)-2H-tetrazole
InChI	InChI=1S/C8H8N4/c1-6-2-4-7(5-3-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)
InChI Key	BCCJIAZPYBJASR-UHFFFAOYSA-N
MDL Number	MFCD01318164
Molecular Formula	C8H8N4
Molecular Weight	160.1759
NSC Number	141938
SMILES	c1c(ccc(c1)C)c1nnn[nH]1
Synonyms	24994-04-5, 5-(4-Methylphenyl)-1H-tetrazole, 5-(p-Tolyl)-1H-tetrazole, 5-p-Tolyl-1H-tetrazole, 5-(4-methylphenyl)-2H-tetrazole, 5-(p-tolyl)-2H-tetrazole, 5-(4-methylphenyl)-2H-1,2,3,4-tetrazole, 5-(4-methylphenyl)-2H-1,2,3,4-tetraazole, 5-P-Methylphenyl-1H-tetrazole, 5-P-Tolyl-2H-Tetrazole, MLS000098927, BCCJIAZPYBJASR-UHFFFAOYSA-N, 5-(4-methylphenyl)tetrazole, MFCD01318164, 2H-Tetrazole, 5-(4-methylphenyl)-, SMR000063542, 4-tolyl tetrazole, methylphenyltetraazole, NSC141938, 5-p-tolyl tetrazole, PubChem9172, AC1Q2KCZ, AC1Q2KFN, Maybridge3_005266, ACMC-1CK4W, AC1L62HE, 5-(p-Tolyl)(1H)tetrazole, SCHEMBL184092, cid_285164, TET003, Jsp004972, CHEMBL1567531, BCCJIAZPYBJASR-UHFFFAOYSA-, BDBM71709, CTK3J6395, 5-(p-methylphenyl)-1h-tetrazole, DTXSID70301238, CHEBI:116179, HMS1445P08, HMS2383J19, KS-000012DZ, ZINC5046002, 2H-Tetrazole,5-(4-methylphenyl)-, ANW-25596, CCG-50054, CM-112, MFCD00277902, SBB000130, STL169565, 5-(4-Methylphenyl)-1H-tetraazole #, AKOS000296813, AKOS000297148, AB05911, AC-7603, AN-8819, MCULE-7892445565, NSC-141938, RP10211, RTR-011457, VZ29931, IDI1_016653, 5-(4-Methylphenyl)-1H-tetrazole, 97%, SC-02877, ST025433, 5-(4-methylphenyl)-1,2,3,4-tetraazole, 5-(4'-METHYLPHENYL)-1H-TETRAZOLE, AB0011097, TR-011457, FT-0619663, FT-0619664, FT-0619907, 5-(4-methylphenyl)-1H-1,2,3,4-tetrazole, 94M045, M-3015, Z-2577, 4-(4-methylphenyl)-1,2,3,5-(1H)-tetrazole, 994M045, A817594, 11T-0833, I01-2497, J-015767, J-516387, SR-01000605077-2, InChI=1/C8H8N4/c1-6-2-4-7(5-3-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12), C8H8N4, CID285164, T2486,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.075g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	160.18g/mol
Monoisotopic Mass	160.075g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	54.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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