dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane

C10H17Cl2P — CID 557323

IUPACdichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane
SMILESCC1(C)C2CCC1(C)C(P(Cl)Cl)C2
InChIInChI=1S/C10H17Cl2P/c1-9(2)7-4-5-10(9,3)8(6-7)13(11)12/h7-8H,4-6H2,1-3H3
InChIKeyNWSKJHMGMCBQAM-UHFFFAOYSA-N
MW239.13 g/mol
LogP4.99
Rot. Bonds1

About dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane

dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane (PubChem CID 557323) has the molecular formula C10H17Cl2P and a molecular weight of 239.13 g/mol. Its IUPAC name is dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane.

Molecular Properties

Compound Namedichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane
PubChem CID557323
Molecular FormulaC10H17Cl2P
Molecular Weight239.13 g/mol
Exact Mass238.04
IUPAC Namedichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane
SMILESCC1(C)C2CCC1(C)C(P(Cl)Cl)C2
InChIInChI=1S/C10H17Cl2P/c1-9(2)7-4-5-10(9,3)8(6-7)13(11)12/h7-8H,4-6H2,1-3H3
InChIKeyNWSKJHMGMCBQAM-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.13
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane?
The IUPAC name of dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane (CID 557323) is dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane.
What is the SMILES notation for dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane?
The canonical SMILES for dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane is CC1(C)C2CCC1(C)C(P(Cl)Cl)C2.
What is the InChIKey of dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane?
The InChIKey is NWSKJHMGMCBQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17Cl2P/c1-9(2)7-4-5-10(9,3)8(6-7)13(11)12/h7-8H,4-6H2,1-3H3.
What are the key properties of dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane?
dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane has a molecular weight of 239.13 g/mol, XLogP of 4.99, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phosphane is sourced from PubChem (CID 557323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).