(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol

C13H14O — CID 130129484

IUPAC(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol
SMILESCC12CC1C(CO)=Cc1ccccc12
InChIInChI=1S/C13H14O/c1-13-7-12(13)10(8-14)6-9-4-2-3-5-11(9)13/h2-6,12,14H,7-8H2,1H3
InChIKeySXMKUSQVHLTORD-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.35
Rot. Bonds1

About (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol

(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol (PubChem CID 130129484) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol.

Molecular Properties

Compound Name(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol
PubChem CID130129484
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol
SMILESCC12CC1C(CO)=Cc1ccccc12
InChIInChI=1S/C13H14O/c1-13-7-12(13)10(8-14)6-9-4-2-3-5-11(9)13/h2-6,12,14H,7-8H2,1H3
InChIKeySXMKUSQVHLTORD-UHFFFAOYSA-N
XLogP2.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7b-methyl-1,1a-dihydrocyclopropa[a]naphthalene
CID 142093034
[2-(2-methoxyphenyl)-2-methylcyclopropyl]methanol
CID 81358735
trimethyl-[(1,1,3,3-tetramethylspiro[cyclobutane-2,1'-indene]-2'-yl)methyl]silane
CID 153467803
[(1S,2R)-2-methyl-2-phenylcyclopropyl]methanol
CID 15781967
[1a-(hydroxymethyl)-1,7b-dihydrocyclopropa[a]naphthalen-2-yl]methanol
CID 139907467
[(1R,2S)-1-methyl-2-phenylcyclopropyl]methanol
CID 10607081
(15S,16R)-1,8-dimethyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,16-diol
CID 125495959
[(1R,8S,15R,22R)-18-(hydroxymethyl)-1,8,15,22-tetramethyl-4-hexacyclo[13.6.1.02,7.08,22.09,14.016,21]docosa-2(7),3,5,9,11,13,16(21),17,19-nonaenyl]methanol
CID 102258216
1,1-dimethylindene-2-carboxamide
CID 174388236
1,10-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6,8,11-pentaene
CID 54000116
2,3-dimethyl-3-phenylcyclobutan-1-ol
CID 175816648
1-(2-bromo-1-methylcyclopropyl)-2-methylbenzene
CID 102395819

Frequently Asked Questions

What is the IUPAC name of (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol?
The IUPAC name of (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol (CID 130129484) is (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol.
What is the SMILES notation for (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol?
The canonical SMILES for (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol is CC12CC1C(CO)=Cc1ccccc12.
What is the InChIKey of (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol?
The InChIKey is SXMKUSQVHLTORD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-13-7-12(13)10(8-14)6-9-4-2-3-5-11(9)13/h2-6,12,14H,7-8H2,1H3.
What are the key properties of (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol?
(7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol has a molecular weight of 186.25 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7b-methyl-1,1a-dihydrocyclopropa[a]naphthalen-2-yl)methanol is sourced from PubChem (CID 130129484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).