AG00C1YF

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CAS Number	26886-05-5
Catalog Number	AG00C1YF(AGN-PC-0JLZYF)
Chemical Name	3,5-Diisopropylphenol
EC Number	248-086-0
IUPAC Name	3,5-di(propan-2-yl)phenol
InChI	InChI=1S/C12H18O/c1-8(2)10-5-11(9(3)4)7-12(13)6-10/h5-9,13H,1-4H3
InChI Key	YYOQJBLGFMMRLJ-UHFFFAOYSA-N
MDL Number	MFCD03703465
Molecular Formula	C12H18O
Molecular Weight	178.2707
SMILES	CC(C)C1=CC(=CC(O)=C1)C(C)C
UNII	35JD906HZZ
Synonyms	3,5-Diisopropylphenol, 26886-05-5, Phenol, 3,5-bis(1-methylethyl)-, Phenol, 3,5-diisopropyl-, UNII-35JD906HZZ, 3,5-di(propan-2-yl)phenol, 35JD906HZZ, YYOQJBLGFMMRLJ-UHFFFAOYSA-N, EINECS 248-086-0, AC1L3PIA, AC1Q79VQ, SCHEMBL2050376, DTXSID0073453, 3,5-bis(1-Methylethyl)-phenol, CTK0J2984, ZINC5761548, 2448AB, ANW-62008, FCH848034, 3,5-BIS(PROPAN-2-YL)PHENOL, AKOS006277280, 3,5-BIS(1-METHYLETHYL)PHENOL, MB02930, 3374-41-2, AJ-54776, AX8234108, DB-067696, TC-064386, A5272, FT-0682372, I14-26782, 3,5-dipropan-2-ylphenol, C12H18O, CID93104, AR-1E9710, C12-H18-O, 34842-85-8,

Complexity	135
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	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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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