(5-tert-butyl-2-methoxyphenyl)-phenylmethanol

C18H22O2 — CID 171366960

IUPAC(5-tert-butyl-2-methoxyphenyl)-phenylmethanol
SMILESCOc1ccc(C(C)(C)C)cc1C(O)c1ccccc1
InChIInChI=1S/C18H22O2/c1-18(2,3)14-10-11-16(20-4)15(12-14)17(19)13-8-6-5-7-9-13/h5-12,17,19H,1-4H3
InChIKeyKVZXBOZSYOUEEB-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.07
Rot. Bonds3

About (5-tert-butyl-2-methoxyphenyl)-phenylmethanol

(5-tert-butyl-2-methoxyphenyl)-phenylmethanol (PubChem CID 171366960) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is (5-tert-butyl-2-methoxyphenyl)-phenylmethanol.

Molecular Properties

Compound Name(5-tert-butyl-2-methoxyphenyl)-phenylmethanol
PubChem CID171366960
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name(5-tert-butyl-2-methoxyphenyl)-phenylmethanol
SMILESCOc1ccc(C(C)(C)C)cc1C(O)c1ccccc1
InChIInChI=1S/C18H22O2/c1-18(2,3)14-10-11-16(20-4)15(12-14)17(19)13-8-6-5-7-9-13/h5-12,17,19H,1-4H3
InChIKeyKVZXBOZSYOUEEB-UHFFFAOYSA-N
XLogP4.07
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methoxy-5-(trifluoromethyl)phenyl]-phenylmethanol;[2-methoxy-5-(trifluoromethyl)phenyl]-phenylmethanone
CID 160587565
(2R)-2-amino-2-(5-tert-butyl-2-methoxyphenyl)ethanol
CID 66514274
1-(5-tert-butyl-2-methoxyphenyl)ethanethiol
CID 116866684
2-amino-2-(5-tert-butyl-2-methoxyphenyl)acetic acid
CID 3582246
amino-(5-tert-butyl-2-methoxyphenyl)methanethiol
CID 116939444
(2-tert-butylphenyl)-phenylmethanol
CID 19438357
1-(5-tert-butyl-2-methoxyphenyl)-1-hydroxybutan-2-one
CID 116835810
(S)-(3,4-dimethoxyphenyl)-phenylmethanol
CID 7154230
1-(5-tert-butyl-2-methoxyphenyl)-N,N-dimethylethanamine
CID 116914596
(2-tert-butylphenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 104546182
(5-chloro-2-methoxyphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63896012
1-(5-tert-butyl-2-methoxyphenyl)-2-(propan-2-ylamino)ethanol
CID 112510982

Frequently Asked Questions

What is the IUPAC name of (5-tert-butyl-2-methoxyphenyl)-phenylmethanol?
The IUPAC name of (5-tert-butyl-2-methoxyphenyl)-phenylmethanol (CID 171366960) is (5-tert-butyl-2-methoxyphenyl)-phenylmethanol.
What is the SMILES notation for (5-tert-butyl-2-methoxyphenyl)-phenylmethanol?
The canonical SMILES for (5-tert-butyl-2-methoxyphenyl)-phenylmethanol is COc1ccc(C(C)(C)C)cc1C(O)c1ccccc1.
What is the InChIKey of (5-tert-butyl-2-methoxyphenyl)-phenylmethanol?
The InChIKey is KVZXBOZSYOUEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-18(2,3)14-10-11-16(20-4)15(12-14)17(19)13-8-6-5-7-9-13/h5-12,17,19H,1-4H3.
What are the key properties of (5-tert-butyl-2-methoxyphenyl)-phenylmethanol?
(5-tert-butyl-2-methoxyphenyl)-phenylmethanol has a molecular weight of 270.37 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-tert-butyl-2-methoxyphenyl)-phenylmethanol is sourced from PubChem (CID 171366960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).