AG00DL7Q

Name: (3-chlorophenyl)(isopropyl)sulfane
Brand: Angene Chemical
SKU: AG00DL7Q

55698-06-1 | (3-chlorophenyl)(isopropyl)sulfane

AG00DL7Q

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CAS Number	55698-06-1
Catalog Number	AG00DL7Q
Chemical Name	(3-chlorophenyl)(isopropyl)sulfane
IUPAC Name	1-chloro-3-propan-2-ylsulfanylbenzene
InChI	InChI=1S/C9H11ClS/c1-7(2)11-9-5-3-4-8(10)6-9/h3-7H,1-2H3
InChI Key	IRFZMQFCTLYYHF-UHFFFAOYSA-N
MDL Number	MFCD26792618
Molecular Formula	C9H11ClS
Molecular Weight	186.7016
SMILES	c1(cccc(c1)SC(C)C)Cl
Synonyms	1-Chloro-3-(propan-2-ylsulfanyl)benzene, 55698-06-1, SCHEMBL12125560, ZINC39281428,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.027g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	186.697g/mol
Monoisotopic Mass	186.027g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	25.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

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