Cas no 39537-10-5 (3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI))
![3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI) structure](https://ossimg.kuujia.com/scimg/40000/39537-10-5x500.png)
39537-10-5 structure
Product Name:3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI)
CAS No:39537-10-5
MF:C13H12N2O2
MW:228.246582984924
CID:298090
PubChem ID:136085679
Update Time:2025-04-19
3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI)
- (3S)-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole-3-carboxylic acid
- (S)-4,9-Dihydro-1-methyl-3H-pyrido[3,4-b]indole-3- carboxylic Acid
- (S)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-3-carboxylic acid
- 39537-10-5
- (S)-4,9-DIHYDRO-1-METHYL-3H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLIC ACID
- (3S)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-3-carboxylic acid
- (S)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-3-carboxylicacid
- (3S)-1-Methyl-3,4-dihydro-2H-beta-carboline-3-carboxylic acid
- SCHEMBL1520349
- DTXSID00721940
-
- Inchi： 1S/C13H12N2O2/c1-7-12-9(6-11(14-7)13(16)17)8-4-2-3-5-10(8)15-12/h2-5,11,15H,6H2,1H3,(H,16,17)/t11-/m0/s1
- InChI Key： DEAAKPHRJVNJBN-NSHDSACASA-N
- SMILES： OC([C@@H]1CC2C3C=CC=CC=3NC=2C(C)=N1)=O
Computed Properties
- Exact Mass: 228.09000
- Monoisotopic Mass: 228.089877630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 366
- 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
- XLogP3: 1.9
- Topological Polar Surface Area: 65.4?2
Experimental Properties
- PSA: 65.45000
- LogP: 1.42180
3H-Pyrido[3,4-b]indole-3-carboxylicacid, 4,9-dihydro-1-methyl-, (S)- (9CI) Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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3. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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