AG01A3A5

Name: 3-Methyl-4-(2-nitrophenyl)butan-2-one
Brand: Angene Chemical
SKU: AG01A3A5

1178221-04-9 | 3-Methyl-4-(2-nitrophenyl)butan-2-one

AG01A3A5

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CAS Number	1178221-04-9
Catalog Number	AG01A3A5
Chemical Name	3-Methyl-4-(2-nitrophenyl)butan-2-one
IUPAC Name	3-methyl-4-(2-nitrophenyl)butan-2-one
InChI	InChI=1S/C11H13NO3/c1-8(9(2)13)7-10-5-3-4-6-11(10)12(14)15/h3-6,8H,7H2,1-2H3
InChI Key	FYBUTKJHAJQBGJ-UHFFFAOYSA-N
MDL Number	MFCD12817397
Molecular Formula	C11H13NO3
Molecular Weight	207.2258
SMILES	CC(C(C)=O)CC1=C([N+]([O-])=O)C=CC=C1
Synonyms	3-methyl-4-(2-nitrophenyl)butan-2-one, 1178221-04-9, NE15577,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.09g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	207.229g/mol
Monoisotopic Mass	207.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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