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4-Methyl-2,6-bis(1-methylpropyl)phenol

HCID 198566
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Basic information

CAS
74926-87-7
Standard SMILES
CCC(C)c1cc(C)cc(C(C)CC)c1O
InChIKey
ZTCKSOLTLREDHC-UHFFFAOYSA-N
Molecular formula
C15H24O
Average molar mass
220.35 g/mol
Monoisotopic mass
220.18271539

Names & identifiers

Preferred name
4-Methyl-2,6-bis(1-methylpropyl)phenol
IUPAC
2,6-di(butan-2-yl)-4-methylphenol
English name
2,6-bis(1-methylpropyl)-p-cresol
Molecular formula
C15H24O
Molecular weight
220.35046

Names & synonyms

74926-87-7RefChem:10710764-Methyl-2,6-bis(1-methylpropyl)phenol2,6-Di-sec-butyl-4-methylphenolBicalutamide Impurity 232,6-Bis(1-methylpropyl)-p-cresolBRN 2557760EINECS 278-029-52,6-di(butan-2-yl)-4-methylphenolPhenol, 2,6-di-sec-butyl-4-methyl-4-06-00-03509 (Beilstein Handbook Reference)CHEMBL29516
Show more names
SCHEMBL6943323DTXSID00996419ZTCKSOLTLREDHC-UHFFFAOYSA-NNS00060031

Database identifiers

CAS
74926-87-7
PubChem CID
198566
DTXSID
DTXSID00996419
ChEMBL
CHEMBL29516
EC Number
278-029-5
Nikkaji
J79.300K

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
182

Chemistry & industry

Suppliers3 total

深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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