8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol

C9H10O — CID 12561909

IUPAC8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
SMILESCC1c2ccccc2C1O
InChIInChI=1S/C9H10O/c1-6-7-4-2-3-5-8(7)9(6)10/h2-6,9-10H,1H3
InChIKeyZXCOOPBIWKNHPF-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.84
Rot. Bonds

About 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol

8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol (PubChem CID 12561909) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol.

Molecular Properties

Compound Name8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
PubChem CID12561909
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
SMILESCC1c2ccccc2C1O
InChIInChI=1S/C9H10O/c1-6-7-4-2-3-5-8(7)9(6)10/h2-6,9-10H,1H3
InChIKeyZXCOOPBIWKNHPF-UHFFFAOYSA-N
XLogP1.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
CID 10535021
7,8-dimethylbicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 159809006
(1S,3R)-1,2,3-trimethyl-2,3-dihydro-1H-indene
CID 58834632
(2R,3R)-3-hydroxy-2-methyl-2,3-dihydroinden-1-one
CID 10534997
(1R,2S,3S,4R)-2,3-dibromo-1,2,3,4-tetrahydronaphthalene-1,4-diol
CID 12740385
(1S,3S)-2-chloro-2,3-dihydro-1H-indene-1,3-diol
CID 10511719
1-ethyl-3-methyl-1,2,3,4-tetrahydroisoquinolin-4-ol
CID 83967471
2,3,4-trimethyl-3,4-dihydro-1H-isoquinolin-1-ol
CID 21053894
(1S,2S)-2,4-dimethyl-1,2-dihydronaphthalen-1-ol
CID 102230606
(1S)-1-methyl-2,3-dihydro-1H-inden-2-ol
CID 89059414
(15S,17R)-15,17-dimethyltetracyclo[6.6.3.02,7.09,14]heptadeca-2,4,6,9,11,13-hexaen-16-ol
CID 10515770
1,3-dimethyl-1,3-dihydroisoindol-2-ide;yttrium
CID 177158601

Frequently Asked Questions

What is the IUPAC name of 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol?
The IUPAC name of 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol (CID 12561909) is 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol.
What is the SMILES notation for 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol?
The canonical SMILES for 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol is CC1c2ccccc2C1O.
What is the InChIKey of 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol?
The InChIKey is ZXCOOPBIWKNHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-6-7-4-2-3-5-8(7)9(6)10/h2-6,9-10H,1H3.
What are the key properties of 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol?
8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol has a molecular weight of 134.18 g/mol, XLogP of 1.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol is sourced from PubChem (CID 12561909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).