Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

tert-Butyl 7-amino-4,4-dimethyl-3,4-dihydroisoquinoline-2(1H)-carboxylate

Related Products

Hot Products

Name

tert-Butyl 7-amino-4,4-dimethyl-3,4-dihydroisoquinoline-2(1H)-carboxylate

EINECS N/A
CAS No. 645418-66-2 Density 1.083 g/cm3
PSA 55.56000 LogP 3.81620
Solubility N/A Melting Point N/A
Formula C16H24N2O2 Boiling Point 396.795 °C at 760 mmHg
Molecular Weight 276.379 Flash Point 193.775 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 645418-66-2 (tert-butyl 7-amino-4,4-dimethyl-3,4-dihydroisoquinoline-2(1H)-carboxylate) Hazard Symbols N/A
Synonyms

7-Amino-4,4-dimethyl-3,4-dihydro-1H-isoquinoline-2-carboxylicacid tert-butyl ester;

Article Data 4

tert-Butyl 7-amino-4,4-dimethyl-3,4-dihydroisoquinoline-2(1H)-carboxylate Specification

The CAS registry number of 2(1H)-Isoquinolinecarboxylicacid, 7-amino-3,4-dihydro-4,4-dimethyl-,1,1-dimethylethyl ester is 645418-66-2. The IUPAC name is tert-butyl 7-amino-4,4-dimethyl-1,3-dihydroisoquinoline-2-carboxylate. In addition, the molecular formula is C16H24N2O2 and the molecular weight is 276.37. What's more, it belongs to the class of Chiral Chemicals. And should be stored in a cool and dry place.

Physical properties about 2(1H)-Isoquinolinecarboxylicacid, 7-amino-3,4-dihydro-4,4-dimethyl-,1,1-dimethylethyl ester are: (1)ACD/LogP: 2.50; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 56; (5)ACD/BCF (pH 7.4): 66; (6)ACD/KOC (pH 5.5): 589; (7)ACD/KOC (pH 7.4): 695; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 55.56 Å2; (12)Index of Refraction: 1.542; (13)Molar Refractivity: 80.366 cm3; (14)Molar Volume: 255.201 cm3; (15)Polarizability: 31.86 ×10-24cm3; (16)Surface Tension: 40.896 dyne/cm; (17)Density: 1.083 g/cm3; (18)Flash Point: 193.775 °C; (19)Enthalpy of Vaporization: 64.715 kJ/mol; (20)Boiling Point: 396.795 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N2Cc1cc(N)ccc1C(C)(C)C2
(2)InChI: InChI=1/C16H24N2O2/c1-15(2,3)20-14(19)18-9-11-8-12(17)6-7-13(11)16(4,5)10-18/h6-8H,9-10,17H2,1-5H3
(3)InChIKey: AIHKRQNBHDKCFX-UHFFFAOYAN

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 645418-66-2