AG01AD3B

Name: 3-Methyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-one
Brand: Angene Chemical
SKU: AG01AD3B

24187-66-4 | 3-Methyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-one

AG01AD3B

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CAS Number	24187-66-4
Catalog Number	AG01AD3B(AGN-PC-002BXM)
Chemical Name	3-Methyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-one
IUPAC Name	3-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one
InChI	InChI=1S/C10H11NOS/c1-7-6-13-9-5-3-2-4-8(9)10(12)11-7/h2-5,7H,6H2,1H3,(H,11,12)
InChI Key	ODLQJZPUEDHIOM-UHFFFAOYSA-N
MDL Number	MFCD24576314
Molecular Formula	C10H11NOS
Molecular Weight	193.2654
SMILES	CC1NC(=O)C2=C(C=CC=C2)SC1
Synonyms	3-methyl-2,3,4,5-tetrahydro-1,4-benzothiazepin-5-one, 24187-66-4, SCHEMBL9635252, AKOS033565338, NE45092,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.056135g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.27g/mol
Monoisotopic Mass	193.056135g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.4Å²
Undefined Atom Stereocenter Count	1
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