(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol

C12H16O — CID 589411

IUPAC(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol
SMILESCc1ccc2c(c1)C(CO)CCC2
InChIInChI=1S/C12H16O/c1-9-5-6-10-3-2-4-11(8-13)12(10)7-9/h5-7,11,13H,2-4,8H2,1H3
InChIKeySRUCIINYFREGPB-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.41
Rot. Bonds1

About (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol

(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol (PubChem CID 589411) has the molecular formula C12H16O and a molecular weight of 176.26 g/mol. Its IUPAC name is (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol
PubChem CID589411
Molecular FormulaC12H16O
Molecular Weight176.26 g/mol
Exact Mass176.12
IUPAC Name(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol
SMILESCc1ccc2c(c1)C(CO)CCC2
InChIInChI=1S/C12H16O/c1-9-5-6-10-3-2-4-11(8-13)12(10)7-9/h5-7,11,13H,2-4,8H2,1H3
InChIKeySRUCIINYFREGPB-UHFFFAOYSA-N
XLogP2.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
CID 19086086
7-methyl-1-(2,2,3,3,3-pentafluoropropyl)-1,2,3,4-tetrahydronaphthalene
CID 129248402
ethyl 2-[8-(hydroxymethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]acetate
CID 139761458
1-[2-(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-3-propylurea
CID 22879761
3-[(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 115765361
N-[2-[(1R)-7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]butanamide
CID 67629054
2-[7-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamine
CID 82542874
(2R)-1-[(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-2-ol
CID 103906801
2-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 15720552
(7-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methanol
CID 83358890
2-(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-amine
CID 83908610
(3-methyl-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanol
CID 105429222

Frequently Asked Questions

What is the IUPAC name of (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The IUPAC name of (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol (CID 589411) is (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol.
What is the SMILES notation for (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The canonical SMILES for (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol is Cc1ccc2c(c1)C(CO)CCC2.
What is the InChIKey of (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
The InChIKey is SRUCIINYFREGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O/c1-9-5-6-10-3-2-4-11(8-13)12(10)7-9/h5-7,11,13H,2-4,8H2,1H3.
What are the key properties of (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol?
(7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol has a molecular weight of 176.26 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanol is sourced from PubChem (CID 589411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).