AG00C8SJ

Name: (3-Aminophenyl)(azepan-1-yl)methanone
Brand: Angene Chemical
SKU: AG00C8SJ

401646-91-1 | (3-Aminophenyl)(azepan-1-yl)methanone

AG00C8SJ

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CAS Number	401646-91-1
Catalog Number	AG00C8SJ(AGN-PC-0WB4ZR)
Chemical Name	(3-Aminophenyl)(azepan-1-yl)methanone
IUPAC Name	(3-aminophenyl)-(azepan-1-yl)methanone
InChI	InChI=1S/C13H18N2O/c14-12-7-5-6-11(10-12)13(16)15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,14H2
InChI Key	HYPNOUVIFRUUJZ-UHFFFAOYSA-N
MDL Number	MFCD08097472
Molecular Formula	C13H18N2O
Molecular Weight	218.2948
SMILES	C(=O)(C1C=CC=C(N)C=1)N1CCCCCC1
Synonyms	401646-91-1, (3-AMINOPHENYL)(1-AZEPANYL)METHANONE, (3-aminophenyl)(azepan-1-yl)methanone, 3-(1-azepanylcarbonyl)aniline, 3-(AZEPAN-1-YLCARBONYL)ANILINE, 3-aminophenyl azaperhydroepinyl ketone, 3-(azepane-1-carbonyl)aniline, ARONIS015029, CTK4I2579, DTXSID10586123, KS-000045BQ, ZINC7468685, 2624AE, BBL011989, MFCD08097472, SBB080324, STK240031, AKOS000133774, MCULE-1736990026, RTR-049362, AJ-57180, TR-049362, ST45051716, Y-3695, C13H18N2O,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.142g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	218.3g/mol
Monoisotopic Mass	218.142g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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