AG019N7V

Name: 1-(azepan-1-yl)butane-1,3-dione
Brand: Angene Chemical
SKU: AG019N7V

78553-62-5 | 1-(azepan-1-yl)butane-1,3-dione

AG019N7V

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CAS Number	78553-62-5
Catalog Number	AG019N7V(AGN-PC-0JNQX4)
Chemical Name	1-(azepan-1-yl)butane-1,3-dione
IUPAC Name	1-(azepan-1-yl)butane-1,3-dione
InChI	InChI=1S/C10H17NO2/c1-9(12)8-10(13)11-6-4-2-3-5-7-11/h2-8H2,1H3
InChI Key	FVCYDMFGFDHYDW-UHFFFAOYSA-N
MDL Number	MFCD00085460
Molecular Formula	C10H17NO2
Molecular Weight	183.2475
NSC Number	74486
SMILES	CC(CC(N1CCCCCC1)=O)=O
Synonyms	1-(azepan-1-yl)butane-1,3-dione, 78553-62-5, 4-azepan-1-yl-4-oxobutan-2-one, 1-azaperhydroepinylbutane-1,3-dione, NSC74486, AC1Q1K1Z, AC1L5M37, AC1Q1K20, CTK7G3237, ZINC4775359, NSC-74486, SBB056520, AKOS000166442, MCULE-8506399923, NE21776, ST50973524, EN300-39621, Z1696870015, N,N-Hexamethyleneacetoacetamide, CID252493,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.126g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.251g/mol
Monoisotopic Mass	183.126g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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