2,3-dihydro-1H-indene;tetrahydrochloride

C9H14Cl4 — CID 175293615

IUPAC2,3-dihydro-1H-indene;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.4ClH/c1-2-5-9-7-3-6-8(9)4-1;;;;/h1-2,4-5H,3,6-7H2;4*1H
InChIKeyRODAXXJGMXNDSW-UHFFFAOYSA-N
MW264.02 g/mol
LogP3.86
Rot. Bonds

About 2,3-dihydro-1H-indene;tetrahydrochloride

2,3-dihydro-1H-indene;tetrahydrochloride (PubChem CID 175293615) has the molecular formula C9H14Cl4 and a molecular weight of 264.02 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene;tetrahydrochloride.

Molecular Properties

Compound Name2,3-dihydro-1H-indene;tetrahydrochloride
PubChem CID175293615
Molecular FormulaC9H14Cl4
Molecular Weight264.02 g/mol
Exact Mass261.98
IUPAC Name2,3-dihydro-1H-indene;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.4ClH/c1-2-5-9-7-3-6-8(9)4-1;;;;/h1-2,4-5H,3,6-7H2;4*1H
InChIKeyRODAXXJGMXNDSW-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.02
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,3-dihydro-1H-indene;methane
CID 158581717
1,2,3,4-tetrahydronaphthalene
CID 174531863
2,3-dihydro-1H-indene;hypobromous acid
CID 174544280
azane;1,2,3,4-tetrahydronaphthalene
CID 22598116
2,3-dihydro-1H-indene;2-methylpropane
CID 91244867
2,3-dihydro-1H-indene;2,2-dimethylpropane
CID 91306466
ethane;6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 143018675
bis(cyclopenta-1,3-diene);2,3-dihydro-1H-indene;zirconium(2+)
CID 159786889
pentacyclo[14.6.2.25,12.06,11.017,22]hexacosa-1(23),5(26),6,8,10,12(25),16(24),17,19,21-decaene
CID 12582397
acetaldehyde;2,3-dihydro-1H-indene;ethane;1,2,3,4-tetrahydronaphthalene
CID 158377760
2,3-dihydro-1H-indene;2-methyl-2,3-dihydro-1H-indene
CID 159163740
2,3-dihydro-1H-indene;methanesulfonate
CID 19699408

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indene;tetrahydrochloride?
The IUPAC name of 2,3-dihydro-1H-indene;tetrahydrochloride (CID 175293615) is 2,3-dihydro-1H-indene;tetrahydrochloride.
What is the SMILES notation for 2,3-dihydro-1H-indene;tetrahydrochloride?
The canonical SMILES for 2,3-dihydro-1H-indene;tetrahydrochloride is Cl.Cl.Cl.Cl.c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-indene;tetrahydrochloride?
The InChIKey is RODAXXJGMXNDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10.4ClH/c1-2-5-9-7-3-6-8(9)4-1;;;;/h1-2,4-5H,3,6-7H2;4*1H.
What are the key properties of 2,3-dihydro-1H-indene;tetrahydrochloride?
2,3-dihydro-1H-indene;tetrahydrochloride has a molecular weight of 264.02 g/mol, XLogP of 3.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indene;tetrahydrochloride is sourced from PubChem (CID 175293615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).