AG00IXP8

Name: 2-[(4-chlorophenyl)sulfanyl]-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
Brand: Angene Chemical
SKU: AG00IXP8

439095-84-8 | 2-[(4-chlorophenyl)sulfanyl]-5,6,7,8-tetrahydro-3-quinolinecarbonitrile

AG00IXP8

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CAS Number	439095-84-8
Catalog Number	AG00IXP8(AGN-PC-0WARW2)
Chemical Name	2-[(4-chlorophenyl)sulfanyl]-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
IUPAC Name	2-(4-chlorophenyl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
InChI	InChI=1S/C16H13ClN2S/c17-13-5-7-14(8-6-13)20-16-12(10-18)9-11-3-1-2-4-15(11)19-16/h5-9H,1-4H2
InChI Key	JDHJQEUZRSLJMA-UHFFFAOYSA-N
MDL Number	MFCD03012871
Molecular Formula	C16H13ClN2S
Molecular Weight	300.8058
SMILES	ClC3(=CC=C(SC2(=NC1(=C(CCCC1)C=C2C#N)))C=C3)
Synonyms	439095-84-8, 2-[(4-chlorophenyl)sulfanyl]-5,6,7,8-tetrahydro-3-quinolinecarbonitrile, 2-[(4-chlorophenyl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile, AC1N7DMH, Oprea1_271779, ZINC4050971, AKOS005084010, MCULE-3130430302, KS-00001U38, 1T-1254, 2-(4-chlorophenyl)sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile, ZINC04050971, CID4300846,

Complexity	372
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	300.049g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	300.804g/mol
Monoisotopic Mass	300.049g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.8

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