4-(4-tert-butylphenyl)-2-methylbutan-1-ol

C15H24O — CID 64666507

IUPAC4-(4-tert-butylphenyl)-2-methylbutan-1-ol
SMILESCC(CO)CCc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H24O/c1-12(11-16)5-6-13-7-9-14(10-8-13)15(2,3)4/h7-10,12,16H,5-6,11H2,1-4H3
InChIKeyASOYCXSJLIOYCZ-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.55
Rot. Bonds4

About 4-(4-tert-butylphenyl)-2-methylbutan-1-ol

4-(4-tert-butylphenyl)-2-methylbutan-1-ol (PubChem CID 64666507) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 4-(4-tert-butylphenyl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name4-(4-tert-butylphenyl)-2-methylbutan-1-ol
PubChem CID64666507
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name4-(4-tert-butylphenyl)-2-methylbutan-1-ol
SMILESCC(CO)CCc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H24O/c1-12(11-16)5-6-13-7-9-14(10-8-13)15(2,3)4/h7-10,12,16H,5-6,11H2,1-4H3
InChIKeyASOYCXSJLIOYCZ-UHFFFAOYSA-N
XLogP3.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-4-[4-(trifluoromethyl)phenyl]butan-1-ol
CID 64666701
1-tert-butyl-4-(4-chloro-3-methylbutyl)benzene
CID 64665458
4-(4-tert-butylphenyl)-N,N-dimethylbutan-2-amine
CID 19885160
4-[5-(4-tert-butylphenyl)-3-methylpentyl]-2-methoxyphenol;methane
CID 161393125
4-[(4-tert-butylphenyl)methylamino]-3-methylbutan-1-ol
CID 66090620
4-(4-tert-butylphenyl)-N-ethylbutan-2-amine
CID 60995834
1-tert-butyl-4-(2-methylbutyl)benzene;ethane
CID 156874515
(2S)-2-[(4-tert-butylphenyl)methylamino]-3-methylbutan-1-ol
CID 79253395
2,2-bis[(4-tert-butylphenyl)methyl]propane-1,3-diol
CID 11057694
6-(4-tert-butylphenyl)-2-methylhexan-3-amine
CID 64504626
methyl 3-[[4-(4-hydroxy-3-methylbutyl)benzoyl]amino]propanoate
CID 67485224
3-(4-tert-butylphenyl)-1-cyclopropylpropan-1-amine
CID 55202631

Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylphenyl)-2-methylbutan-1-ol?
The IUPAC name of 4-(4-tert-butylphenyl)-2-methylbutan-1-ol (CID 64666507) is 4-(4-tert-butylphenyl)-2-methylbutan-1-ol.
What is the SMILES notation for 4-(4-tert-butylphenyl)-2-methylbutan-1-ol?
The canonical SMILES for 4-(4-tert-butylphenyl)-2-methylbutan-1-ol is CC(CO)CCc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 4-(4-tert-butylphenyl)-2-methylbutan-1-ol?
The InChIKey is ASOYCXSJLIOYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-12(11-16)5-6-13-7-9-14(10-8-13)15(2,3)4/h7-10,12,16H,5-6,11H2,1-4H3.
What are the key properties of 4-(4-tert-butylphenyl)-2-methylbutan-1-ol?
4-(4-tert-butylphenyl)-2-methylbutan-1-ol has a molecular weight of 220.36 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylphenyl)-2-methylbutan-1-ol is sourced from PubChem (CID 64666507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).