AG005C1K

Name: 3-Propanoylbenzoic acid
Brand: Angene Chemical
SKU: AG005C1K

74380-71-5 | 3-Propanoylbenzoic acid

AG005C1K

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CAS Number	74380-71-5
Catalog Number	AG005C1K(AGN-PC-00O8BV)
Chemical Name	3-Propanoylbenzoic acid
IUPAC Name	3-propanoylbenzoic acid
InChI	InChI=1S/C10H10O3/c1-2-9(11)7-4-3-5-8(6-7)10(12)13/h3-6H,2H2,1H3,(H,12,13)
InChI Key	GJXGVUOQOFRNKR-UHFFFAOYSA-N
MDL Number	MFCD02260860
Molecular Formula	C10H10O3
Molecular Weight	178.1846
SMILES	C1(C=CC=C(C=1)C(CC)=O)C(=O)O
Synonyms	3-PROPIONYLBENZOIC ACID, 74380-71-5, 3-propanoylbenzoic acid, Benzoic acid,3-(1-oxopropyl)-, 3-propanylbenzoic acid, SCHEMBL4667454, CTK5D9778, DTXSID90551218, GJXGVUOQOFRNKR-UHFFFAOYSA-N, Benzoic acid, 3-(1-oxopropyl)-, ZINC2579855, 9085AE, MFCD02260860, AKOS006277746, FT-0732018, 3-PROPIONYLBENZOICACID, 3-(1-oxopropyl)Benzoic acid, C10H10O3,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.187g/mol
Monoisotopic Mass	178.063g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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