1,2,3,6-tetramethylbicyclo[2.2.0]hexane

C10H18 — CID 123570801

IUPAC1,2,3,6-tetramethylbicyclo[2.2.0]hexane
SMILESCC1C(C)C2(C)C(C)CC12
InChIInChI=1S/C10H18/c1-6-5-9-7(2)8(3)10(6,9)4/h6-9H,5H2,1-4H3
InChIKeyWJWUGSSEXMTWHK-UHFFFAOYSA-N
MW138.25 g/mol
LogP2.93
Rot. Bonds

About 1,2,3,6-tetramethylbicyclo[2.2.0]hexane

1,2,3,6-tetramethylbicyclo[2.2.0]hexane (PubChem CID 123570801) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 1,2,3,6-tetramethylbicyclo[2.2.0]hexane.

Molecular Properties

Compound Name1,2,3,6-tetramethylbicyclo[2.2.0]hexane
PubChem CID123570801
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name1,2,3,6-tetramethylbicyclo[2.2.0]hexane
SMILESCC1C(C)C2(C)C(C)CC12
InChIInChI=1S/C10H18/c1-6-5-9-7(2)8(3)10(6,9)4/h6-9H,5H2,1-4H3
InChIKeyWJWUGSSEXMTWHK-UHFFFAOYSA-N
XLogP2.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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(1S,2R,3S,7S)-1,2,7-trimethyltricyclo[3.2.1.03,8]octane
CID 163751027
1-methyltricyclo[2.1.0.02,5]pentane
CID 86129037
1,2,3,6-tetramethyl-2-propan-2-ylbicyclo[2.2.0]hexane
CID 123893883
2,2,3,5-tetramethylbicyclo[2.1.1]hexane
CID 123374497
1,2,3,9,10-pentamethyltetracyclo[4.4.0.02,5.07,10]decane
CID 123696260
10,12,16-trimethyloctacyclo[7.6.1.01,8.02,5.02,7.03,15.011,14.011,16]hexadecane
CID 143326459
1-(2-hydroperoxy-1,3,6,7-tetramethyl-2-bicyclo[3.2.0]heptanyl)-2-hydroxyethanone
CID 59942607
1,2,4,6-tetramethylspiro[2.3]hexane
CID 91567702
(2S)-1,1,2-trimethylcyclopropane
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ethene;6-methyl-3-azabicyclo[3.1.1]heptane
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Frequently Asked Questions

What is the IUPAC name of 1,2,3,6-tetramethylbicyclo[2.2.0]hexane?
The IUPAC name of 1,2,3,6-tetramethylbicyclo[2.2.0]hexane (CID 123570801) is 1,2,3,6-tetramethylbicyclo[2.2.0]hexane.
What is the SMILES notation for 1,2,3,6-tetramethylbicyclo[2.2.0]hexane?
The canonical SMILES for 1,2,3,6-tetramethylbicyclo[2.2.0]hexane is CC1C(C)C2(C)C(C)CC12.
What is the InChIKey of 1,2,3,6-tetramethylbicyclo[2.2.0]hexane?
The InChIKey is WJWUGSSEXMTWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-6-5-9-7(2)8(3)10(6,9)4/h6-9H,5H2,1-4H3.
What are the key properties of 1,2,3,6-tetramethylbicyclo[2.2.0]hexane?
1,2,3,6-tetramethylbicyclo[2.2.0]hexane has a molecular weight of 138.25 g/mol, XLogP of 2.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,6-tetramethylbicyclo[2.2.0]hexane is sourced from PubChem (CID 123570801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).