AG01C55M

Name: 3-Methyl-1-(pyridin-4-yl)butan-1-one
Brand: Angene Chemical
SKU: AG01C55M

79251-07-3 | 3-Methyl-1-(pyridin-4-yl)butan-1-one

AG01C55M

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CAS Number	79251-07-3
Catalog Number	AG01C55M(AGN-PC-002E73)
Chemical Name	3-Methyl-1-(pyridin-4-yl)butan-1-one
IUPAC Name	3-methyl-1-pyridin-4-ylbutan-1-one
InChI	InChI=1S/C10H13NO/c1-8(2)7-10(12)9-3-5-11-6-4-9/h3-6,8H,7H2,1-2H3
InChI Key	OXKATPYKOFUGFU-UHFFFAOYSA-N
MDL Number	MFCD12153292
Molecular Formula	C10H13NO
Molecular Weight	163.2163
SMILES	CC(CC(C1=CC=NC=C1)=O)C
Synonyms	3-methyl-1-(pyridin-4-yl)butan-1-one, 79251-07-3, 1-Butanone, 3-methyl-1-(4-pyridinyl)-, isobutyl 4-pyridyl ketone, SCHEMBL9670161, OXKATPYKOFUGFU-UHFFFAOYSA-N, ZINC34354726, AKOS010014809, Z2418194302,

Complexity	148
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.1g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	163.22g/mol
Monoisotopic Mass	163.1g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	30A^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