CAS 102-97-6

Interquim comes from an international group of 50 companies active in the pharma, hospital, diagnostics, fine chemicals & feed sectors.

Virtual Booth

Contact Supplier

Rusan Pharma: Over 30 years of specializing in the treatment of Addiction and Pain Management.

CHEMISTRY

Discover Molecule Insights

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 102-97-6, N-benzylisopropylamine, N-benzylpropan-2-amine, N-benzyl-n-isopropylamine, Isopropylbenzylamine, Benzenemethanamine, n-(1-methylethyl)-

Molecular Formula

C₁₀H₁₅N

Molecular Weight

149.23 g/mol

InChI Key

LYBKPDDZTNUNNM-UHFFFAOYSA-N

FDA UNII

67SYC92FNS

1 2D Structure

CAS 102-97-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-benzylpropan-2-amine

2.1.2 InChI

InChI=1S/C10H15N/c1-9(2)11-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3

2.1.3 InChI Key

LYBKPDDZTNUNNM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C)NCC1=CC=CC=C1

2.2 Other Identifiers

2.2.1 UNII

67SYC92FNS

2.3 Synonyms

2.3.1 MeSH Synonyms

1. N-benzyl-n-isopropylamine

2. N-benzylisopropylamine

2.3.2 Depositor-Supplied Synonyms

1. 102-97-6

2. N-benzylisopropylamine

3. N-benzylpropan-2-amine

4. N-benzyl-n-isopropylamine

5. Isopropylbenzylamine

6. Benzenemethanamine, N-(1-methylethyl)-

7. Benzylisopropylamine

8. Benzylamine, N-isopropyl-

9. N-(1-methylethyl)-benzenemethanamine

10. N-isopropyl-n-benzylamine

11. Mfcd00008863

12. 67syc92fns

13. Nsc-60295

14. N-benzyl Isopropylamine

15. N-isopropylbenzylamine (hydrochloride)

16. Benzyl(propan-2-yl)amine

17. Einecs 203-067-6

18. Isopropyl Benzylamine

19. Nsc 60295

20. Benzyl-isopropyl-amine

21. Ai3-26799

22. Unii-67syc92fns

23. N-isopropylbenzylamine, 97%

24. Schembl143708

25. Chembl3229275

26. Dtxsid8059265

27. (1-methylethyl)(phenylmethyl)amine

28. Nsc60295

29. Stk500594

30. Akos000119921

31. Cs-w020642

32. As-63527

33. Sy032809

34. N-(1-methylethyl)benzenemethanamine

35. Db-000330

36. B1216

37. Ns00023197

38. C11247

39. N-isopropylbenzylamine, Purum, >=97.0% (gc)

40. Q3511281

41. W-108862

42. Inchi=1/c10h15n/c1-9(2)11-8-10-6-4-3-5-7-10/h3-7,9,11h,8h2,1-2h

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₅N
Molecular Weight	149.23 g/mol
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	12
Heavy Atom Count	11
Formal Charge	0
Complexity	93
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

CAS 102-97-6 manufacturers and suppliers on PharmaCompass

CHEMISTRY

Discover Molecule Insights

What are you looking for?