AG01A0XO

Name: 4-(2-Chloro-4-methylphenoxy)butanoic acid
Brand: Angene Chemical
SKU: AG01A0XO

40629-77-4 | 4-(2-Chloro-4-methylphenoxy)butanoic acid

AG01A0XO

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CAS Number	40629-77-4
Catalog Number	AG01A0XO
Chemical Name	4-(2-Chloro-4-methylphenoxy)butanoic acid
IUPAC Name	4-(2-chloro-4-methylphenoxy)butanoic acid
InChI	InChI=1S/C11H13ClO3/c1-8-4-5-10(9(12)7-8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)
InChI Key	LCJRUFKEVHYJBQ-UHFFFAOYSA-N
MDL Number	MFCD16842046
Molecular Formula	C11H13ClO3
Molecular Weight	228.6721
SMILES	CC1=CC(Cl)=C(OCCCC(O)=O)C=C1
Synonyms	4-(2-chloro-4-methylphenoxy)butanoic acid, 40629-77-4, SCHEMBL15445592, ZINC54348430, AKOS005288253, MCULE-7489854878, NE46242, Z1436472936,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.055g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	228.672g/mol
Monoisotopic Mass	228.055g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

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