AG0001VI

Name: 4-(Pentanoylamino)benzoic acid
Brand: Angene Chemical
SKU: AG0001VI

100390-76-9 | 4-(Pentanoylamino)benzoic acid

AG0001VI

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CAS Number	100390-76-9
Catalog Number	AG0001VI(AGN-PC-0LH5BQ)
Chemical Name	4-(Pentanoylamino)benzoic acid
IUPAC Name	4-(pentanoylamino)benzoic acid
InChI	InChI=1S/C12H15NO3/c1-2-3-4-11(14)13-10-7-5-9(6-8-10)12(15)16/h5-8H,2-4H2,1H3,(H,13,14)(H,15,16)
InChI Key	SBQFPXHBAJDVLV-UHFFFAOYSA-N
MDL Number	MFCD01365923
Molecular Formula	C12H15NO3
Molecular Weight	221.2524
SMILES	C(O)(=O)C1C=CC(=CC=1)NC(CCCC)=O
Synonyms	4-(pentanoylamino)benzoic acid, 100390-76-9, 4-pentanamidobenzoic acid, Benzoic acid, 4-[(1-oxopentyl)amino]-, AC1NGPHY, Oprea1_101455, CTK3J8894, DTXSID80406485, ALBB-003605, ZINC7260906, 7152AC, BBL002139, MFCD01365923, STK414812, AKOS000104496, MCULE-8285784105, AJ-57104, AB0218322, TR-053715, ST50721634, W-8260, Z224140742, C12H15NO3, CID4777990,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	221.256g/mol
Monoisotopic Mass	221.105g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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