CAS 17610-20-7

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Also known as: Refchem:486451, 660-853-5, 17610-20-7, 3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde, 3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbaldehyde, 2-naphthalenecarboxaldehyde,5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-

Molecular Formula

C₁₆H₂₂O

Molecular Weight

230.34 g/mol

InChI Key

JEJZFUVABODMHT-UHFFFAOYSA-N

1 2D Structure

CAS 17610-20-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbaldehyde

2.1.2 InChI

InChI=1S/C16H22O/c1-11-8-13-14(9-12(11)10-17)16(4,5)7-6-15(13,2)3/h8-10H,6-7H2,1-5H3

2.1.3 InChI Key

JEJZFUVABODMHT-UHFFFAOYSA-N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Refchem:486451

2. 660-853-5

3. 17610-20-7

4. 3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde

5. 3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbaldehyde

6. 2-naphthalenecarboxaldehyde,5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-

7. Mfcd00156897

8. 5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenecarboxaldehyde

9. 1,1,4,4,7-pentamethyltetralin-6-carbaldehyde

10. Nsc17410

11. Schembl4666462

12. Schembl8521714

13. Dtxsid30280550

14. Jejzfuvabodmht-uhfffaoysa-n

15. Nsc-17410

16. Akos022181855

17. Sy405930

18. Cs-0529401

19. F79785

20. 2-formyl-3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-naphthalene

21. 2-formyl-3-methyl-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene

22. 2-naphthalenecarboxaldehyde, 5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-

23. 5,6,7,8-tetrahydro-3,5,5,8,8-pentamethylnaphthalene-2-carbaldehyde

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₆H₂₂O
Molecular Weight	230.34 g/mol
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	17.1
Heavy Atom Count	17
Formal Charge	0
Complexity	303
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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