AG01A3GH

Name: 2-(Cyclopentylsulfanyl)-5-nitrobenzoic acid
Brand: Angene Chemical
SKU: AG01A3GH

1282254-35-6 | 2-(Cyclopentylsulfanyl)-5-nitrobenzoic acid

AG01A3GH

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COA

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CAS Number	1282254-35-6
Catalog Number	AG01A3GH
Chemical Name	2-(Cyclopentylsulfanyl)-5-nitrobenzoic acid
IUPAC Name	2-cyclopentylsulfanyl-5-nitrobenzoic acid
InChI	InChI=1S/C12H13NO4S/c14-12(15)10-7-8(13(16)17)5-6-11(10)18-9-3-1-2-4-9/h5-7,9H,1-4H2,(H,14,15)
InChI Key	IROZTJFPECGGGS-UHFFFAOYSA-N
MDL Number	MFCD19444127
Molecular Formula	C12H13NO4S
Molecular Weight	267.3009
SMILES	OC(C1=C(SC2CCCC2)C=CC([N+]([O-])=O)=C1)=O
Synonyms	2-(cyclopentylsulfanyl)-5-nitrobenzoic acid, 1282254-35-6, ZINC58015014, AKOS009003416, NE42656, Z90135046,

Complexity	325
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.057g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	267.299g/mol
Monoisotopic Mass	267.057g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	108A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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