AG002509

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CAS Number	17696-37-6
Catalog Number	AG002509(AGN-PC-0JLWO1)
Chemical Name	4-tert-Butyl-2,5-dimethylphenol
EC Number	241-696-8
IUPAC Name	4-tert-butyl-2,5-dimethylphenol
InChI	InChI=1S/C12H18O/c1-8-7-11(13)9(2)6-10(8)12(3,4)5/h6-7,13H,1-5H3
InChI Key	ZSPDNAYHQYQUPC-UHFFFAOYSA-N
MDL Number	MFCD24713532
Molecular Formula	C12H18O
Molecular Weight	178.2707
SMILES	CC1=C(O)C=C(C)C(C(C)(C)C)=C1
Synonyms	17696-37-6, Phenol, 4-(1,1-dimethylethyl)-2,5-dimethyl-, 4-tert-butyl-2,5-dimethylphenol, 2,5-dimethyl-4-(1,1-dimethylethyl)-phenol, 4-tert-Butyl-2,5-xylenol, EINECS 241-696-8, 4-t-Butyl-2,5-xylenol, AC1Q79TU, 2,5-dimethyl-4-t-butylphenol, AC1L3D93, SCHEMBL1245497, DTXSID5066247, CTK4D6372, ZSPDNAYHQYQUPC-UHFFFAOYSA-N, ZINC5765125, 4-(1,1-Dimethylethyl)-2,5-dimethylphenol, Phenol,4-(1,1-dimethylethyl)-2,5-dimethyl-, Phenyl 4-hydroxybenzoate, C12H18O, CID87249, AR-1L0314, C12-H18-O, 81471-55-8,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.136g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.275g/mol
Monoisotopic Mass	178.136g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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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