AG01AB4L

Name: 2-[2-(Propan-2-yl)phenoxy]butanoic acid
Brand: Angene Chemical
SKU: AG01AB4L

161790-49-4 | 2-[2-(Propan-2-yl)phenoxy]butanoic acid

AG01AB4L

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CAS Number	161790-49-4
Catalog Number	AG01AB4L
Chemical Name	2-[2-(Propan-2-yl)phenoxy]butanoic acid
IUPAC Name	2-(2-propan-2-ylphenoxy)butanoic acid
InChI	InChI=1S/C13H18O3/c1-4-11(13(14)15)16-12-8-6-5-7-10(12)9(2)3/h5-9,11H,4H2,1-3H3,(H,14,15)
InChI Key	ZOTASNZXNMVFMO-UHFFFAOYSA-N
MDL Number	MFCD03422258
Molecular Formula	C13H18O3
Molecular Weight	222.2802
SMILES	CCC(C(O)=O)OC1=C(C(C)C)C=CC=C1
Synonyms	2-[2-(propan-2-yl)phenoxy]butanoic acid, 161790-49-4, AC1Q2SLO, SCHEMBL5861162, CTK6C7443, AKOS000308678, MCULE-6420079954, NE44758, 2-(2-ISOPROPYLPHENOXY)BUTANOIC ACID, EN300-70467,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.126g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.284g/mol
Monoisotopic Mass	222.126g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.5

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