AG006W35

2581-34-2 | 3-Methyl-4-nitrophenol

AG006W35

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CAS Number	2581-34-2
Catalog Number	AG006W35(AGN-PC-0JKDGB)
Chemical Name	3-Methyl-4-nitrophenol
EC Number	219-952-5
IUPAC Name	3-methyl-4-nitrophenol
InChI	InChI=1S/C7H7NO3/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,9H,1H3
InChI Key	PIIZYNQECPTVEO-UHFFFAOYSA-N
MDL Number	MFCD00007333
Molecular Formula	C7H7NO3
Molecular Weight	153.1354
NSC Number	69190
SMILES	C1=C([N+]([O-])=O)C(=CC(=C1)O)C
UNII	2CC94832EU
Synonyms	3-methyl-4-nitrophenol, 4-nitro-3-cresol, 4-nitro-3-cresol, sodium salt, p-nitro-m-cresol, 3-Methyl-4-nitrophenol, 2581-34-2, 4-Nitro-m-cresol, 4-Nitro-3-cresol, 5-Hydroxy-2-nitrotoluene, 4-Nitro-3-methylphenol, 2-Nitro-5-hydroxytoluene, Phenol, 3-methyl-4-nitro-, 4-Nitro-5-methylphenol, m-Cresol, 4-nitro-, P-NITRO-M-CRESOL, 4-Nitro-1-hydroxy-3-methylbenzene, NSC 69190, UNII-2CC94832EU, 5-Methyl-4-nitrophenol, 3-methyl-4-nitro-phenol, EINECS 219-952-5, MFCD00007333, 4-NITRO-META-CRESOL, BRN 1868105, AI3-19030, PIIZYNQECPTVEO-UHFFFAOYSA-N, 2CC94832EU, 3-Methyl-4-nitrophenol (4-Nitro-m-cresol), 4-nitro-m-creso, NSC69190, p-Nitro-m-methylphenol, PubChem21648, ACMC-209gmn, 3-methyl-4-nitro-pheno, WLN: WNR DQ B1, AC1L29YH, 4-NITRO-ORTHO-CRESOL, 4-06-00-02075 (Beilstein Handbook Reference), KSC493C0N, SCHEMBL214252, 3-Methyl-4-nitrophenol, 98%, DTXSID2062535, CHEBI:38683, CTK3J3106, KS-00000LNK, OTAVA-BB 1023289, LABOTEST-BB LTBB004358, ACT00837, ANW-25821, BBL011500, LABOTEST-BB LT03378993, NSC-69190, SBB058858, STL146612, ZINC19230181, AKOS000121313, AC-7840, AN-8588, AS00180, MCULE-4604041897, RP21705, RTR-011720, VZ29519, AJ-72657, AK-49132, AS-11958, BR-49132, CJ-16044, LS-55426, SC-22409, AB1008105, DB-003082, ST2417794, TL8002082, TR-011720, 3-Methyl-4-nitrophenol, analytical standard, 4-Nitro-m-cresol; 5-Hydroxy-2-nitrotoluene, FT-0616094, N0351, ST50458865, AZ0001-0107, M-6191, N-2650, AE-562/43285825, I14-0315, Z85922875, F0001-0858, InChI=1/C7H7NO3/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,9H,1H, 4-Nitro-o-cresol, 4-nitro-3-phenylphenol, 4-Nitro-2-methylphenol, 2-Hydroxy-5-nitrotoluene, 3-methyl-4-nitrophenolate, C7H7NO3, Phenol, 2-methyl-4-nitro-, 2-METHYL-4-NITROPHENOL, 4-nitro-3-cresol, sodium salt, C7-H7-N-O3, CID17412, Phenol,3-methyl-4-nitro-,labeledwithcarbon-14, 3-Methyl-4-nitrophenol, 98% - 100G 100g, C008636, 910311-23-8,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.137g/mol
Monoisotopic Mass	153.043g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 2446

Certificate of Analysis

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