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

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

CAS：81-03-8
MW:188.314
MF：C14H20

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Names and ldentifier
Msds
Computational chemical data
Realated Product Infomation

1. Names and Identifiers

1.1 Name: 1H-Indene,2,3-dihydro-1,1,3,3,5-pentamethyl-

1.2 Synonyms: 1,1,3,3,5-pentamethyl indane; 1,1,3,3,5-Pentamethyl-2,3-dihydro-1H-indene; 1,1,3,3,5-pentamethyl-2h-indene; 1,1,3,3,5-pentamethylindan; 1,1,3,3,5-pentamethylindane; 1h-indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-; 2,3-Dihydro-1,1,3,3,5-pentamethyl-1H-indene; 201-316-3; AC1L25FU; AKOS006271790; DTXSID2058837; einecs 201-316-3; Indan, 1,1,3,3,5-pentamethyl-; Indan,1,1,3,3,5-pentamethyl- (6CI,7CI,8CI); MFCD00046323; NNXHDILUOAXSPU-UHFFFAOYSA-N;

1.3 CAS No.: 81-03-8

1.4 CID: 66469

1.5 EINECS: 201-316-3

1.6 Molecular Formula: C14H20

1.7 Inchi: InChI=1S/C14H20/c1-10-6-7-11-12(8-10)14(4,5)9-13(11,2)3/h6-8H,9H2,1-5H3

1.8 InChkey: NNXHDILUOAXSPU-UHFFFAOYSA-N

1.9 Canonical Smiles: CC1=CC2=C(C=C1)C(CC2(C)C)(C)C

1.10 Isomers Smiles: CC1=CC2=C(C=C1)C(CC2(C)C)(C)C

2. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

3. Synthesis Route

81-03-8Total: 9 Synthesis Route

1195-32-0

1195-32-0 31 Suppliers

81-03-8

81-03-8 1 Suppliers

57095-05-3

57095-05-3

81-03-8

81-03-8 1 Suppliers

4. Precursor and Product

precursor:

75-85-4

75-85-4

100963-80-2

100963-80-2

75-65-0

75-65-0

57095-05-3

57095-05-3

1195-32-0

1195-32-0

99-87-6

99-87-6

115-11-7

115-11-7

product:

116-66-5

116-66-5

5. Computed Properties

Molecular Weight：188.314g/mol
Molecular Formula：C₁₄H₂₀
Compound Is Canonicalized：True
Exact Mass：4.9
XLogP3-AA：188.156500638
Monoisotopic Mass：188.156500638
Complexity：224
Rotatable Bond Count：0
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：0
Topological Polar Surface Area：0
Heavy Atom Count：：14
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADceBwAAAAAAAAAAAAAAAAAAAAAYAAAAAwAAAAAAAAAGABAAAAGAAAAAAADgCAGAAyAIAAAACAAiBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAgMAPwAACAAAQAACAAAQAACAAAQAACAAAAA==

6. Toltal 1 Suppliers View more

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

Hubei Jiutian Bio-medical Technology Co., Ltd

^1YR

Tel: Update Time:2024/09/17

inquire

7. Realated Product Infomation

1. Names and Identifiers

1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 EINECS(EC#)
1.5 Molecular Formula
1.6 Inchi
1.7 InChkey
1.8 Canonical Smiles
1.9 Isomers Smiles

3. Synthesis Route

4. Precursor and Product

5. Computational chemical data

6. Toltal 1 Suppliers

7. Realated Product Infomation

CAS Products Suppliers

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