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1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-

HCID 66469
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
81-03-8
Standard SMILES
Cc1ccc2c(c1)C(C)(C)CC2(C)C
InChIKey
NNXHDILUOAXSPU-UHFFFAOYSA-N
Molecular formula
C14H20
Average molar mass
188.31 g/mol
Monoisotopic mass
188.15650064

Names & identifiers

Preferred name
1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-
IUPAC
1,1,3,3,5-pentamethyl-2H-indene

Names & synonyms

1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-81-03-8EINECS 201-316-3DTXSID2058837RefChem:438590DTXCID50481841,1,3,3,5-Pentamethylindan1,1,3,3,5-pentamethyl-2H-indene1,1,3,3,5-pentamethyl-2,3-dihydro-1H-indene1,1,3,3,5-pentamethylindaneSCHEMBL3179509SCHEMBL11218909
Show more names
AKOS0062717901,1,3,3,5-PENTAMETHYL INDANEDB-215733NS00004114

Database identifiers

CAS
81-03-8
PubChem CID
66469
DTXSID
DTXSID2058837
EC Number
201-316-3
Nikkaji
J192.581D

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
224

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationChemical: 1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-: ACTIVE

Related reactions

2 records
New reaction record
HRID 394920 reaction equation
HRID 394920As reactantuspto-grants-2003_08
HRID 1221563 reaction equation
HRID 1221563As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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