3,4,5,7-tetramethylnaphthalen-1-ol

C14H16O — CID 91028901

IUPAC3,4,5,7-tetramethylnaphthalen-1-ol
SMILESCc1cc(C)c2c(C)c(C)cc(O)c2c1
InChIInChI=1S/C14H16O/c1-8-5-10(3)14-11(4)9(2)7-13(15)12(14)6-8/h5-7,15H,1-4H3
InChIKeyYUQKXIMDPAPNFR-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.78
Rot. Bonds

About 3,4,5,7-tetramethylnaphthalen-1-ol

3,4,5,7-tetramethylnaphthalen-1-ol (PubChem CID 91028901) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is 3,4,5,7-tetramethylnaphthalen-1-ol.

Molecular Properties

Compound Name3,4,5,7-tetramethylnaphthalen-1-ol
PubChem CID91028901
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name3,4,5,7-tetramethylnaphthalen-1-ol
SMILESCc1cc(C)c2c(C)c(C)cc(O)c2c1
InChIInChI=1S/C14H16O/c1-8-5-10(3)14-11(4)9(2)7-13(15)12(14)6-8/h5-7,15H,1-4H3
InChIKeyYUQKXIMDPAPNFR-UHFFFAOYSA-N
XLogP3.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,4,6,8-pentamethylnaphthalene
CID 59866689
3,4,5-trimethylnaphthalen-1-ol
CID 54424732
3,4,5,6,7,8-hexamethylnaphthalen-1-ol
CID 20665127
3,5-dimethylbenzene-1,2-diol;3,4,5-trimethylbenzene-1,2-diol
CID 22492701
2,3,4,5,7-pentamethylnaphthalene-1-sulfinic acid
CID 57481919
2,3,5-trimethylphenol;2,3,6-trimethylphenol
CID 70540570
3,4-dimethylnaphthalen-1-ol
CID 15915434
1,2,3,4-tetramethylbenzene;bis(1,2,3,5-tetramethylbenzene)
CID 158514008
5,7-dimethylnaphthalen-1-ol
CID 599056
2,6-dimethylnaphthalene-1,4-diol
CID 121008161
3,6,8-trimethylpyren-1-ol
CID 154487222
2,6-dimethylphenol;2,3,5-trimethylphenol
CID 69435633

Frequently Asked Questions

What is the IUPAC name of 3,4,5,7-tetramethylnaphthalen-1-ol?
The IUPAC name of 3,4,5,7-tetramethylnaphthalen-1-ol (CID 91028901) is 3,4,5,7-tetramethylnaphthalen-1-ol.
What is the SMILES notation for 3,4,5,7-tetramethylnaphthalen-1-ol?
The canonical SMILES for 3,4,5,7-tetramethylnaphthalen-1-ol is Cc1cc(C)c2c(C)c(C)cc(O)c2c1.
What is the InChIKey of 3,4,5,7-tetramethylnaphthalen-1-ol?
The InChIKey is YUQKXIMDPAPNFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-8-5-10(3)14-11(4)9(2)7-13(15)12(14)6-8/h5-7,15H,1-4H3.
What are the key properties of 3,4,5,7-tetramethylnaphthalen-1-ol?
3,4,5,7-tetramethylnaphthalen-1-ol has a molecular weight of 200.28 g/mol, XLogP of 3.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,7-tetramethylnaphthalen-1-ol is sourced from PubChem (CID 91028901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).