AG000Y3D

Name: Methyl 3-nitro-4-(propylamino)benzoate
Brand: Angene Chemical
SKU: AG000Y3D

128429-03-8 | Methyl 3-nitro-4-(propylamino)benzoate

AG000Y3D

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CAS Number	128429-03-8
Catalog Number	AG000Y3D(AGN-PC-001NC8)
Chemical Name	Methyl 3-nitro-4-(propylamino)benzoate
IUPAC Name	methyl 3-nitro-4-(propylamino)benzoate
InChI	InChI=1S/C11H14N2O4/c1-3-6-12-9-5-4-8(11(14)17-2)7-10(9)13(15)16/h4-5,7,12H,3,6H2,1-2H3
InChI Key	YNIMKYLYDRQUQA-UHFFFAOYSA-N
MDL Number	MFCD17171059
Molecular Formula	C11H14N2O4
Molecular Weight	238.2399
SMILES	CCCNC1=C([N+]([O-])=O)C=C(C(OC)=O)C=C1
Synonyms	Methyl 3-nitro-4-(propylamino)benzoate, 128429-03-8, ACMC-209bf4, SCHEMBL5315342, CTK8A9995, DTXSID60560832, ANW-19070, ZINC34304634, AKOS015899009, CJ-18289, TC-107815, Z9425, Benzoic acid, 3-nitro-4-(propylamino)-, methyl ester, I14-12383, C11H14N2O4,

Complexity	277
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.095g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	238.243g/mol
Monoisotopic Mass	238.095g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	84.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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