Cas no 102206-91-7 (9H-Pyrido[3,4-b]indol-6-amine,1-methyl-)
102206-91-7 structure
Product Name:9H-Pyrido[3,4-b]indol-6-amine,1-methyl-
CAS No:102206-91-7
MF:C12H11N3
MW:197.235841989517
CID:147466
PubChem ID:24844818
Update Time:2025-04-19
9H-Pyrido[3,4-b]indol-6-amine,1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Pyrido[3,4-b]indol-6-amine,1-methyl-
- 1-methyl-9H-pyrido[3,4-b]indol-6-amine
- 1-methyl-9H-β-carbolin-6-amine
- LogP
- 6-Aminoharman
- DTXSID10144762
- 9H-Pyrido(3,4-b)indole, 6-amino-1-methyl-
- 102206-91-7
- 4-25-00-02682 (Beilstein Handbook Reference)
- BRN 0170630
-
- Inchi: 1S/C12H11N3/c1-7-12-9(4-5-14-7)10-6-8(13)2-3-11(10)15-12/h2-6,15H,13H2,1H3
- InChI Key: ZPIXSVIDESIDHF-UHFFFAOYSA-N
- SMILES: N1C2C=CC(=CC=2C2C=CN=C(C)C1=2)N
Computed Properties
- Exact Mass: 196.0876
- Monoisotopic Mass: 197.095297364g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 243
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 54.7?2
Experimental Properties
- Density: 1.334
- Boiling Point: 469.3°C at 760 mmHg
- Flash Point: 268.8°C
- Refractive Index: 1.806
- PSA: 54.7
- LogP: 3.18790
9H-Pyrido[3,4-b]indol-6-amine,1-methyl- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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