AG01DTD0

Name: 5-Chloro-2-isopropylbenzoic acid
Brand: Angene Chemical
SKU: AG01DTD0

1369813-02-4 | 5-Chloro-2-isopropylbenzoic acid

AG01DTD0

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CAS Number	1369813-02-4
Catalog Number	AG01DTD0
Chemical Name	5-Chloro-2-isopropylbenzoic acid
IUPAC Name	5-chloro-2-propan-2-ylbenzoic acid
InChI	InChI=1S/C10H11ClO2/c1-6(2)8-4-3-7(11)5-9(8)10(12)13/h3-6H,1-2H3,(H,12,13)
InChI Key	HIHNXAIDKKRHQL-UHFFFAOYSA-N
MDL Number	MFCD28356768
Molecular Formula	C10H11ClO2
Molecular Weight	198.6461
SMILES	CC(C1=C(C(O)=O)C=C(Cl)C=C1)C
Synonyms	5-chloro-2-(propan-2-yl)benzoic acid, 1369813-02-4, SCHEMBL17465965, AKOS024072144,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.045g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	198.646g/mol
Monoisotopic Mass	198.045g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^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