ethane;tricyclo[4.4.0.02,8]decane

C14H28 — CID 91556011

IUPACethane;tricyclo[4.4.0.02,8]decane
SMILESC1CC2CC3CCC2C3C1.CC.CC
InChIInChI=1S/C10H16.2C2H6/c1-2-7-6-8-4-5-10(7)9(8)3-1;2*1-2/h7-10H,1-6H2;2*1-2H3
InChIKeyDDMUIEYWGAXMRO-UHFFFAOYSA-N
MW196.38 g/mol
LogP4.89
Rot. Bonds

About ethane;tricyclo[4.4.0.02,8]decane

ethane;tricyclo[4.4.0.02,8]decane (PubChem CID 91556011) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is ethane;tricyclo[4.4.0.02,8]decane.

Molecular Properties

Compound Nameethane;tricyclo[4.4.0.02,8]decane
PubChem CID91556011
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Nameethane;tricyclo[4.4.0.02,8]decane
SMILESC1CC2CC3CCC2C3C1.CC.CC
InChIInChI=1S/C10H16.2C2H6/c1-2-7-6-8-4-5-10(7)9(8)3-1;2*1-2/h7-10H,1-6H2;2*1-2H3
InChIKeyDDMUIEYWGAXMRO-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.38
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tricyclo[4.4.0.02,8]decane
CID 585864
(7S)-tricyclo[5.2.1.02,6]decane
CID 154529079
tetracyclo[9.7.0.03,8.012,16]octadecane
CID 140868120
ethane;3-methyl-2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthrene
CID 143732334
2,3,4,4a,4b,5,6,7,8,8a,9,9a-dodecahydro-1H-fluorene
CID 21972
3-methyl-2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthrene
CID 20683773
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;bicyclo[2.2.1]heptane;cyclohexane;cyclopentane;ethane;tetracyclo[6.2.1.13,6.02,7]dodecane;tricyclo[5.2.1.02,6]decane
CID 162115588
carbanide;dichlorozirconium(2+);pentacyclo[13.7.0.04,12.05,10.017,22]docosane
CID 162298653
(8S,9R,13S)-2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthrene
CID 145133460
tetracyclo[6.6.2.22,7.19,14]nonadecane
CID 123381567
tetracyclo[6.3.1.02,6.010,12]dodecane
CID 146743747
2-methyl-2,3,4,4a,4b,5,6,7,8,8a,9,9a-dodecahydro-1H-fluorene
CID 71773994

Frequently Asked Questions

What is the IUPAC name of ethane;tricyclo[4.4.0.02,8]decane?
The IUPAC name of ethane;tricyclo[4.4.0.02,8]decane (CID 91556011) is ethane;tricyclo[4.4.0.02,8]decane.
What is the SMILES notation for ethane;tricyclo[4.4.0.02,8]decane?
The canonical SMILES for ethane;tricyclo[4.4.0.02,8]decane is C1CC2CC3CCC2C3C1.CC.CC.
What is the InChIKey of ethane;tricyclo[4.4.0.02,8]decane?
The InChIKey is DDMUIEYWGAXMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.2C2H6/c1-2-7-6-8-4-5-10(7)9(8)3-1;2*1-2/h7-10H,1-6H2;2*1-2H3.
What are the key properties of ethane;tricyclo[4.4.0.02,8]decane?
ethane;tricyclo[4.4.0.02,8]decane has a molecular weight of 196.38 g/mol, XLogP of 4.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;tricyclo[4.4.0.02,8]decane is sourced from PubChem (CID 91556011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).