10-chlorotricyclo[4.3.1.03,8]dec-4-ene

C10H13Cl — CID 561709

IUPAC10-chlorotricyclo[4.3.1.03,8]dec-4-ene
SMILESClC1C2C=CC3CC1CC3C2
InChIInChI=1S/C10H13Cl/c11-10-7-2-1-6-3-9(10)5-8(6)4-7/h1-2,6-10H,3-5H2
InChIKeyPTJBCHBGTJGYLO-UHFFFAOYSA-N
MW168.67 g/mol
LogP2.83
Rot. Bonds

About 10-chlorotricyclo[4.3.1.03,8]dec-4-ene

10-chlorotricyclo[4.3.1.03,8]dec-4-ene (PubChem CID 561709) has the molecular formula C10H13Cl and a molecular weight of 168.67 g/mol. Its IUPAC name is 10-chlorotricyclo[4.3.1.03,8]dec-4-ene.

Molecular Properties

Compound Name10-chlorotricyclo[4.3.1.03,8]dec-4-ene
PubChem CID561709
Molecular FormulaC10H13Cl
Molecular Weight168.67 g/mol
Exact Mass168.07
IUPAC Name10-chlorotricyclo[4.3.1.03,8]dec-4-ene
SMILESClC1C2C=CC3CC1CC3C2
InChIInChI=1S/C10H13Cl/c11-10-7-2-1-6-3-9(10)5-8(6)4-7/h1-2,6-10H,3-5H2
InChIKeyPTJBCHBGTJGYLO-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.67
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1R,4S,5R,6R)-5,6-dichlorobicyclo[2.2.1]hept-2-ene
CID 23270288
4-ethylbicyclo[4.1.0]hept-2-ene
CID 23283002
(1R,2S,5R,6R)-tricyclo[4.2.1.12,5]deca-3,7-diene
CID 98626620
(1R,2S,5S,6R)-tricyclo[4.2.1.12,5]deca-3,7-diene
CID 98626622
2,3-dichlorobicyclo[2.2.1]heptane
CID 3613638
(3-chloro-2-bicyclo[2.2.1]hept-5-enyl) acetate
CID 66903254
tetracyclo[7.7.1.02,7.010,15]heptadeca-3,5,11,13-tetraene
CID 59047597
(1R,3R)-3-chlorotricyclo[2.2.1.02,6]heptane
CID 102212512
(1S,2S,3R,6R,7S,8S,9S)-9-chlorotetracyclo[6.2.1.13,6.02,7]dodec-4-ene
CID 98505466
(2R,4S,5S)-2,4-dichlorobicyclo[3.2.1]oct-6-en-3-one
CID 22489717
tricyclo[4.2.1.03,8]non-4-ene
CID 15329735
4,10-dichloro-2-azatricyclo[3.3.1.13,7]decane
CID 130020808

Frequently Asked Questions

What is the IUPAC name of 10-chlorotricyclo[4.3.1.03,8]dec-4-ene?
The IUPAC name of 10-chlorotricyclo[4.3.1.03,8]dec-4-ene (CID 561709) is 10-chlorotricyclo[4.3.1.03,8]dec-4-ene.
What is the SMILES notation for 10-chlorotricyclo[4.3.1.03,8]dec-4-ene?
The canonical SMILES for 10-chlorotricyclo[4.3.1.03,8]dec-4-ene is ClC1C2C=CC3CC1CC3C2.
What is the InChIKey of 10-chlorotricyclo[4.3.1.03,8]dec-4-ene?
The InChIKey is PTJBCHBGTJGYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl/c11-10-7-2-1-6-3-9(10)5-8(6)4-7/h1-2,6-10H,3-5H2.
What are the key properties of 10-chlorotricyclo[4.3.1.03,8]dec-4-ene?
10-chlorotricyclo[4.3.1.03,8]dec-4-ene has a molecular weight of 168.67 g/mol, XLogP of 2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-chlorotricyclo[4.3.1.03,8]dec-4-ene is sourced from PubChem (CID 561709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).