(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol

C17H26O — CID 102185202

IUPAC(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol
SMILESCc1cc2c(cc1CO)C(C)(C)CC(C)C2(C)C
InChIInChI=1S/C17H26O/c1-11-7-15-14(8-13(11)10-18)16(3,4)9-12(2)17(15,5)6/h7-8,12,18H,9-10H2,1-6H3
InChIKeyGCBPXGIMZKMKQC-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.08
Rot. Bonds1

About (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol

(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol (PubChem CID 102185202) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol.

Molecular Properties

Compound Name(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol
PubChem CID102185202
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol
SMILESCc1cc2c(cc1CO)C(C)(C)CC(C)C2(C)C
InChIInChI=1S/C17H26O/c1-11-7-15-14(8-13(11)10-18)16(3,4)9-12(2)17(15,5)6/h7-8,12,18H,9-10H2,1-6H3
InChIKeyGCBPXGIMZKMKQC-UHFFFAOYSA-N
XLogP4.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol?
The IUPAC name of (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol (CID 102185202) is (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol.
What is the SMILES notation for (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol?
The canonical SMILES for (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol is Cc1cc2c(cc1CO)C(C)(C)CC(C)C2(C)C.
What is the InChIKey of (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol?
The InChIKey is GCBPXGIMZKMKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-11-7-15-14(8-13(11)10-18)16(3,4)9-12(2)17(15,5)6/h7-8,12,18H,9-10H2,1-6H3.
What are the key properties of (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol?
(3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol has a molecular weight of 246.39 g/mol, XLogP of 4.08, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5,5,6,8,8-hexamethyl-6,7-dihydronaphthalen-2-yl)methanol is sourced from PubChem (CID 102185202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).