(2-methoxyanthracen-1-yl)methanol

C16H14O2 — CID 102344428

IUPAC(2-methoxyanthracen-1-yl)methanol
SMILESCOc1ccc2cc3ccccc3cc2c1CO
InChIInChI=1S/C16H14O2/c1-18-16-7-6-13-8-11-4-2-3-5-12(11)9-14(13)15(16)10-17/h2-9,17H,10H2,1H3
InChIKeyDWYREMWQCULLPY-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.49
Rot. Bonds2

About (2-methoxyanthracen-1-yl)methanol

(2-methoxyanthracen-1-yl)methanol (PubChem CID 102344428) has the molecular formula C16H14O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is (2-methoxyanthracen-1-yl)methanol.

Molecular Properties

Compound Name(2-methoxyanthracen-1-yl)methanol
PubChem CID102344428
Molecular FormulaC16H14O2
Molecular Weight238.29 g/mol
Exact Mass238.10
IUPAC Name(2-methoxyanthracen-1-yl)methanol
SMILESCOc1ccc2cc3ccccc3cc2c1CO
InChIInChI=1S/C16H14O2/c1-18-16-7-6-13-8-11-4-2-3-5-12(11)9-14(13)15(16)10-17/h2-9,17H,10H2,1H3
InChIKeyDWYREMWQCULLPY-UHFFFAOYSA-N
XLogP3.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-[(2-methoxynaphthalen-1-yl)methoxy]anthracene
CID 71427905
6-bromo-2-methoxy-1-methylnaphthalene;(6-bromo-2-methoxynaphthalen-1-yl)methanol
CID 70197174
[2-(methoxymethoxy)naphthalen-1-yl]methanol
CID 65364950
(7-methoxyisoquinolin-8-yl)methanol
CID 82576311
7-(2-methoxynaphthalen-1-yl)benzo[a]anthracene
CID 71619168
2-methoxy-1,6-bis[(2-methoxynaphthalen-1-yl)methyl]naphthalene
CID 139095345
2-hydroxyethyl-[(2-methoxynaphthalen-1-yl)methyl]azanium
CID 7322221
4-(2-methoxynaphthalen-1-yl)anthracen-2-ol
CID 132597550
[2-(3-methylbutoxy)naphthalen-1-yl]methanol
CID 43505713
1,2-bis[(4-methoxyphenyl)methyl]anthracene
CID 174931223
(2R)-1-(2-methoxynaphthalen-1-yl)propan-2-ol
CID 92532795
4-(2-methoxynaphthalen-1-yl)butane-1,2-diol
CID 82185801

Frequently Asked Questions

What is the IUPAC name of (2-methoxyanthracen-1-yl)methanol?
The IUPAC name of (2-methoxyanthracen-1-yl)methanol (CID 102344428) is (2-methoxyanthracen-1-yl)methanol.
What is the SMILES notation for (2-methoxyanthracen-1-yl)methanol?
The canonical SMILES for (2-methoxyanthracen-1-yl)methanol is COc1ccc2cc3ccccc3cc2c1CO.
What is the InChIKey of (2-methoxyanthracen-1-yl)methanol?
The InChIKey is DWYREMWQCULLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O2/c1-18-16-7-6-13-8-11-4-2-3-5-12(11)9-14(13)15(16)10-17/h2-9,17H,10H2,1H3.
What are the key properties of (2-methoxyanthracen-1-yl)methanol?
(2-methoxyanthracen-1-yl)methanol has a molecular weight of 238.29 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyanthracen-1-yl)methanol is sourced from PubChem (CID 102344428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).