AG0002H4

Name: Methyl 4-(butylcarbamoyl)benzoate
Brand: Angene Chemical
SKU: AG0002H4

100610-03-5 | Methyl 4-(butylcarbamoyl)benzoate

AG0002H4

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CAS Number	100610-03-5
Catalog Number	AG0002H4(AGN-PC-01COGC)
Chemical Name	Methyl 4-(butylcarbamoyl)benzoate
IUPAC Name	methyl 4-(butylcarbamoyl)benzoate
InChI	InChI=1S/C13H17NO3/c1-3-4-9-14-12(15)10-5-7-11(8-6-10)13(16)17-2/h5-8H,3-4,9H2,1-2H3,(H,14,15)
InChI Key	RTOAFYYWYCMMTQ-UHFFFAOYSA-N
MDL Number	MFCD09418666
Molecular Formula	C13H17NO3
Molecular Weight	235.2790
SMILES	CCCCNC(=O)c1ccc(cc1)C(=O)OC
Synonyms	Methyl 4-(butylcarbamoyl)benzoate, 100610-03-5, ACMC-2097r9, CTK8A8980, DTXSID10589376, 0234AA, ANW-14323, MFCD09418666, ZINC10454596, AKOS003564159, AJ-59716, CJ-13630, 4-(Butylcarbamoyl)benzoic acid methyl ester, AX8243339, TC-103068, B-8449, Benzoic acid, 4-[(butylamino)carbonyl]-, methyl ester, Methyl4-(butylcarbamoyl)benzoate, C13H17NO3,

Complexity	257
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.121g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	235.283g/mol
Monoisotopic Mass	235.121g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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