(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane

C8H19P — CID 171834213

IUPAC(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane
SMILESCC1(C)C2CCC[C@H]21.P.[H][H]
InChIInChI=1S/C8H14.H3P.H2/c1-8(2)6-4-3-5-7(6)8;;/h6-7H,3-5H2,1-2H3;1H3;1H/t6-,7?;;/m1../s1
InChIKeyCRYWKOIOJGYYSW-DKPBNVODSA-N
MW146.21 g/mol
LogP2.75
Rot. Bonds

About (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane

(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane (PubChem CID 171834213) has the molecular formula C8H19P and a molecular weight of 146.21 g/mol. Its IUPAC name is (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane.

Molecular Properties

Compound Name(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane
PubChem CID171834213
Molecular FormulaC8H19P
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane
SMILESCC1(C)C2CCC[C@H]21.P.[H][H]
InChIInChI=1S/C8H14.H3P.H2/c1-8(2)6-4-3-5-7(6)8;;/h6-7H,3-5H2,1-2H3;1H3;1H/t6-,7?;;/m1../s1
InChIKeyCRYWKOIOJGYYSW-DKPBNVODSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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CID 85195042
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CID 90260929
4,4,6-trimethyl-2,3,3a,4a,5,6,7,8,8a,8b-decahydro-1H-cyclopenta[a]indene
CID 142551529
(1R,5R)-6,6-dimethylbicyclo[3.1.1]heptane
CID 91146278
(6-methyl-6-bicyclo[3.1.0]hexanyl)methanol
CID 75109427
(9aR)-9-cyclohexyl-10,10-dimethyl-2,3,4,4a,5,6,7,8,8a,9,9a,10a-dodecahydro-1H-anthracene
CID 140752694
7-fluoro-8,8-dimethyl-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalene
CID 22156449
trans-(1S,3S)-2,2,3-trimethylcyclohexan-1-amine
CID 96559139
1,10-dimethyl-10-azatricyclo[5.2.1.02,6]decane
CID 57117556
1,8,11-trimethyltricyclo[6.5.1.02,7]tetradecane
CID 154517445
(4S,7aS)-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-4-ol
CID 143298757
3,7,7-trimethylbicyclo[4.1.0]heptan-3-ol
CID 155663554

Frequently Asked Questions

What is the IUPAC name of (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane?
The IUPAC name of (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane (CID 171834213) is (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane.
What is the SMILES notation for (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane?
The canonical SMILES for (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane is CC1(C)C2CCC[C@H]21.P.[H][H].
What is the InChIKey of (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane?
The InChIKey is CRYWKOIOJGYYSW-DKPBNVODSA-N. The full InChI is InChI=1S/C8H14.H3P.H2/c1-8(2)6-4-3-5-7(6)8;;/h6-7H,3-5H2,1-2H3;1H3;1H/t6-,7?;;/m1../s1.
What are the key properties of (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane?
(5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane has a molecular weight of 146.21 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-6,6-dimethylbicyclo[3.1.0]hexane;molecular hydrogen;phosphane is sourced from PubChem (CID 171834213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).