3-Phenylpropene

Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

Virtual Booth

Contact Supplier

Jai Radhe Sales is your partner for all your sourcing needs.

CHEMISTRY

Discover Molecule Insights

BUILDING BLOCK

1 Suppliers

1 Suppliers

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 300-57-2, 2-propenylbenzene, 3-phenyl-1-propene, Benzene, 2-propenyl-, Prop-2-enylbenzene, 3-phenylpropene

Molecular Formula

C₉H₁₀

Molecular Weight

118.18 g/mol

InChI Key

HJWLCRVIBGQPNF-UHFFFAOYSA-N

allylbenzene is a natural product found in Alpinia officinarum with data available.

1 2D Structure

CAS 300-57-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

prop-2-enylbenzene

2.1.2 InChI

InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2

2.1.3 InChI Key

HJWLCRVIBGQPNF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C=CCC1=CC=CC=C1

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 300-57-2

2. 2-propenylbenzene

3. 3-phenyl-1-propene

4. Benzene, 2-propenyl-

5. Prop-2-enylbenzene

6. 3-phenylpropene

7. Benzene, Allyl-

8. Allyl Benzene

9. 1-phenyl-2-propene

10. 1-propene, 3-phenyl-

11. (prop-2-en-1-yl)benzene

12. Benzene, 2-propen-1-yl-, Homopolymer

13. 1-benzylethene

14. 25988-53-8

15. Einecs 206-095-7

16. Nsc 18609

17. Benzene, 2-propen-1-yl-

18. Brn 1098501

19. Allyl-benzene

20. Mfcd00008651

21. Allylbenzene, 98%

22. Prop-2-en-1-ylbenzene

23. 2-propen-1-yl-benzene

24. Unii-3vt7c9meq9

25. 3vt7c9meq9

26. 4-05-00-01362 (beilstein Handbook Reference)

27. Chembl501879

28. Dtxsid00861855

29. Nsc18609

30. Zinc1561526

31. Nsc-18609

32. Stl268883

33. Akos000121504

34. Cs-w011219

35. Fd14063

36. Ol10164

37. As-48898

38. Allylbenzene 100 Microg/ml In Acetonitrile

39. Db-029432

40. Ft-0622040

41. P0609

42. A820164

43. J-017751

44. Q56435819

45. F0001-0925

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₀
Molecular Weight	118.18 g/mol
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	118.078250319 g/mol
Monoisotopic Mass	118.078250319 g/mol
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	78
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

BUILDING BLOCK

Upload your portfolio for free, ask us

SUPPLIERS

Only 10 entries up to this point, click to access all

CAS 300-57-2 manufacturers and suppliers on PharmaCompass

CHEMISTRY

Discover Molecule Insights

BUILDING BLOCK

1 Suppliers

What are you looking for?