(1-methylnaphthalen-2-yl)methanol

C12H12O — CID 15054223

IUPAC(1-methylnaphthalen-2-yl)methanol
SMILESCc1c(CO)ccc2ccccc12
InChIInChI=1S/C12H12O/c1-9-11(8-13)7-6-10-4-2-3-5-12(9)10/h2-7,13H,8H2,1H3
InChIKeyCAZAKZQHCQEODF-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.64
Rot. Bonds1

About (1-methylnaphthalen-2-yl)methanol

(1-methylnaphthalen-2-yl)methanol (PubChem CID 15054223) has the molecular formula C12H12O and a molecular weight of 172.23 g/mol. Its IUPAC name is (1-methylnaphthalen-2-yl)methanol.

Molecular Properties

Compound Name(1-methylnaphthalen-2-yl)methanol
PubChem CID15054223
Molecular FormulaC12H12O
Molecular Weight172.23 g/mol
Exact Mass172.09
IUPAC Name(1-methylnaphthalen-2-yl)methanol
SMILESCc1c(CO)ccc2ccccc12
InChIInChI=1S/C12H12O/c1-9-11(8-13)7-6-10-4-2-3-5-12(9)10/h2-7,13H,8H2,1H3
InChIKeyCAZAKZQHCQEODF-UHFFFAOYSA-N
XLogP2.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1-methylnaphthalen-2-yl)methanol?
The IUPAC name of (1-methylnaphthalen-2-yl)methanol (CID 15054223) is (1-methylnaphthalen-2-yl)methanol.
What is the SMILES notation for (1-methylnaphthalen-2-yl)methanol?
The canonical SMILES for (1-methylnaphthalen-2-yl)methanol is Cc1c(CO)ccc2ccccc12.
What is the InChIKey of (1-methylnaphthalen-2-yl)methanol?
The InChIKey is CAZAKZQHCQEODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O/c1-9-11(8-13)7-6-10-4-2-3-5-12(9)10/h2-7,13H,8H2,1H3.
What are the key properties of (1-methylnaphthalen-2-yl)methanol?
(1-methylnaphthalen-2-yl)methanol has a molecular weight of 172.23 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylnaphthalen-2-yl)methanol is sourced from PubChem (CID 15054223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).