2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]

C22H21Cl — CID 156577036

IUPAC2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]
SMILESClc1ccc2c(c1)C1(c3ccccc3-2)C2CCC3CC(C2)CC31
InChIInChI=1S/C22H21Cl/c23-16-7-8-18-17-3-1-2-4-19(17)22(21(18)12-16)15-6-5-14-9-13(10-15)11-20(14)22/h1-4,7-8,12-15,20H,5-6,9-11H2
InChIKeyYSVZSEIPOYNDAR-UHFFFAOYSA-N
MW320.86 g/mol
LogP6.06
Rot. Bonds

About 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]

2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] (PubChem CID 156577036) has the molecular formula C22H21Cl and a molecular weight of 320.86 g/mol. Its IUPAC name is 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane].

Molecular Properties

Compound Name2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]
PubChem CID156577036
Molecular FormulaC22H21Cl
Molecular Weight320.86 g/mol
Exact Mass320.13
IUPAC Name2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]
SMILESClc1ccc2c(c1)C1(c3ccccc3-2)C2CCC3CC(C2)CC31
InChIInChI=1S/C22H21Cl/c23-16-7-8-18-17-3-1-2-4-19(17)22(21(18)12-16)15-6-5-14-9-13(10-15)11-20(14)22/h1-4,7-8,12-15,20H,5-6,9-11H2
InChIKeyYSVZSEIPOYNDAR-UHFFFAOYSA-N
XLogP6.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.86
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2'-chloro-1,3-dideuteriospiro[adamantane-2,9'-fluorene]
CID 176825160
3-chloro-5-phenylspiro[fluorene-9,2'-tricyclo[3.3.1.03,7]nonane]
CID 170085615
2'-chloro-7'-phenylspiro[adamantane-2,9'-fluorene]
CID 169099363
7-[10-(9,9-diphenyl-7-spiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]-2-ylfluoren-2-yl)anthracen-9-yl]isoquinoline
CID 167165097
9-(7'-chlorospiro[adamantane-2,9'-fluorene]-2'-yl)carbazole
CID 156578319
3'-(7-chloro-9,9-dimethylfluoren-2-yl)-3,7-dimethylspiro[bicyclo[3.3.1]nonane-2,9'-fluorene]
CID 156573187
2-phenyl-4-(2-phenylphenyl)-6-(10-spiro[fluorene-9,2'-tricyclo[3.3.1.03,7]nonane]-2-ylanthracen-9-yl)-1,3,5-triazine
CID 156577191
2'-chloro-4'-phenylspiro[adamantane-2,9'-fluorene]
CID 168798512
2-(4-chloro-2,3-dimethylnaphthalen-1-yl)spiro[fluorene-9,2'-tricyclo[4.3.1.13,8]undecane]
CID 155393697
2-(6'-chlorospiro[adamantane-2,9'-fluorene]-2'-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 168803912
3-chloro-7-spiro[adamantane-2,9'-fluorene]-3'-yldibenzothiophene
CID 168803759
6'-chloro-2'-(9,9-dimethylfluoren-3-yl)-7-ethyl-3-methylspiro[bicyclo[3.3.1]nonane-2,9'-fluorene]
CID 170046374

Frequently Asked Questions

What is the IUPAC name of 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]?
The IUPAC name of 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] (CID 156577036) is 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane].
What is the SMILES notation for 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]?
The canonical SMILES for 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] is Clc1ccc2c(c1)C1(c3ccccc3-2)C2CCC3CC(C2)CC31.
What is the InChIKey of 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]?
The InChIKey is YSVZSEIPOYNDAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21Cl/c23-16-7-8-18-17-3-1-2-4-19(17)22(21(18)12-16)15-6-5-14-9-13(10-15)11-20(14)22/h1-4,7-8,12-15,20H,5-6,9-11H2.
What are the key properties of 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane]?
2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] has a molecular weight of 320.86 g/mol, XLogP of 6.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorospiro[fluorene-9,7'-tricyclo[4.3.1.03,8]decane] is sourced from PubChem (CID 156577036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).