AG00JVFT

Name: 1-(3-Fluorobenzoyl)-1,4-diazepane
Brand: Angene Chemical
SKU: AG00JVFT

926215-33-0 | 1-(3-Fluorobenzoyl)-1,4-diazepane

AG00JVFT

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CAS Number	926215-33-0
Catalog Number	AG00JVFT(AGN-PC-0WOPJP)
Chemical Name	1-(3-Fluorobenzoyl)-1,4-diazepane
IUPAC Name	1,4-diazepan-1-yl-(3-fluorophenyl)methanone
InChI	InChI=1S/C12H15FN2O/c13-11-4-1-3-10(9-11)12(16)15-7-2-5-14-6-8-15/h1,3-4,9,14H,2,5-8H2
InChI Key	KRKTYJDNTSZEOX-UHFFFAOYSA-N
MDL Number	MFCD09043044
Molecular Formula	C12H15FN2O
Molecular Weight	222.2587
SMILES	FC1=CC(C(N2CCNCCC2)=O)=CC=C1
Synonyms	1-(3-fluorobenzoyl)-1,4-diazepane, 926215-33-0, 1,4-diazepan-1-yl(3-fluorophenyl)methanone, AC1Q4LJ5, CTK7C1595, KS-00001NVR, BBL018181, MFCD09043044, STL183871, ZINC19679939, AKOS002433945, MCULE-1731716223, NE32363, EN300-31049, Z228587576,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.117g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.263g/mol
Monoisotopic Mass	222.117g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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