4-Tert-butyl-3-methoxyphenol

HCID 12252976CAS 19545-76-7
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Basic information

Standard SMILES
COc1cc(O)ccc1C(C)(C)C
InChIKey
HLRRPPJCSHECRZ-UHFFFAOYSA-N
Molecular formula
C11H16O2
Average molar mass
180.24 g/mol
Monoisotopic mass
180.11502975

Names & identifiers

Preferred name
4-Tert-butyl-3-methoxyphenol
IUPAC
4-tert-butyl-3-methoxyphenol

Names & synonyms

19545-76-74-TERT-BUTYL-3-METHOXYPHENOL4-(tert-Butyl)-3-methoxyphenolPhenol, 4-(1,1-dimethylethyl)-3-methoxy-MFCD00017257SCHEMBL1516118SCHEMBL10592818DTXSID80482547HLRRPPJCSHECRZ-UHFFFAOYSA-NMB002713-methoxy-4-(1,1-dimethylethyl)phenolDA-38963
Show more names
SY316143

Database identifiers

CAS
19545-76-7
PubChem CID
12252976
DTXSID
DTXSID80482547
Nikkaji
J175.235I

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13

Related reactions

6 records
New reaction record

Linked notes

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