AG0039GY

Name: 1-(5-methyl-2-nitrophenyl)ethanone
Brand: Angene Chemical
SKU: AG0039GY

69976-70-1 | 1-(5-methyl-2-nitrophenyl)ethanone

AG0039GY

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CAS Number	69976-70-1
Catalog Number	AG0039GY(AGN-PC-00FSD6)
Chemical Name	1-(5-methyl-2-nitrophenyl)ethanone
IUPAC Name	1-(5-methyl-2-nitrophenyl)ethanone
InChI	InChI=1S/C9H9NO3/c1-6-3-4-9(10(12)13)8(5-6)7(2)11/h3-5H,1-2H3
InChI Key	QTVGOWDJTGISJG-UHFFFAOYSA-N
MDL Number	MFCD11046202
Molecular Formula	C9H9NO3
Molecular Weight	179.1727
SMILES	CC=1C=CC(=C(C1)C(C)=O)[N+](=O)[O-]
Synonyms	1-(5-Methyl-2-nitrophenyl)ethanone, 69976-70-1, 1-(5-methyl-2-nitrophenyl)ethan-1-one, Ethanone, 1-(5-methyl-2-nitrophenyl)-, SCHEMBL1277039, QTVGOWDJTGISJG-UHFFFAOYSA-N, KS-00000R4U, MFCD11046202, ZINC19045633, 1-(5-methyl-2-nitrophenyl) ethanone, AKOS006309183, CH-0704, 1-(5-Methyl-2-nitro-phenyl)-ethanone, AJ-70752, AK145645, 1(5-METHYL-2-NITROPHENYL) ETHANONE, FT-0695977, 1-(5-methyl-2-nitro-phenyl)ethanone, CID11769120,

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	179.175g/mol
Monoisotopic Mass	179.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	62.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited