Cas no 350508-61-1 (Isoquinoline,1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)-)
350508-61-1 structure
Product Name:Isoquinoline,1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)-
CAS No:350508-61-1
MF:C12H17N
MW:175.270083189011
CID:302806
PubChem ID:45096651
Update Time:2025-04-19
Isoquinoline,1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)- Chemical and Physical Properties
Names and Identifiers
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- Isoquinoline,1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)-
- Isoquinoline, 1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)- (9CI)
- (R)-4-Isopropyl-1,2,3,4-tetrahydroisoquinoline
- 350508-61-1
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- Inchi： 1S/C12H17N/c1-9(2)12-8-13-7-10-5-3-4-6-11(10)12/h3-6,9,12-13H,7-8H2,1-2H3/t12-/m1/s1
- InChI Key： RZNYSRIQQBTKIF-GFCCVEGCSA-N
- SMILES： N1CC2C=CC=CC=2[C@H](C1)C(C)C
Computed Properties
- Exact Mass: 175.136
- Monoisotopic Mass: 175.136
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 165
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 12A^2
- XLogP3: 2.4
Isoquinoline,1,2,3,4-tetrahydro-4-(1-methylethyl)-, (4R)- Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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