Cas no 148915-76-8 (Benzoic acid,2-amino-5-hydroxy-, 8-methylnonyl ester)
148915-76-8 structure
Product Name:Benzoic acid,2-amino-5-hydroxy-, 8-methylnonyl ester
CAS No:148915-76-8
MF:C17H27NO3
MW:293.401185274124
CID:147214
PubChem ID:192421
Update Time:2025-04-19
Benzoic acid,2-amino-5-hydroxy-, 8-methylnonyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,2-amino-5-hydroxy-, 8-methylnonyl ester
- 8-methylnonyl 2-amino-5-hydroxybenzoate
- BU 4601 A
- BU-4601 A
- Isodecyl 5-hydroxyanthranilate
- DTXSID40164135
- 148915-76-8
- SCHEMBL9498528
- CHEBI:217843
- BU-4601A
-
- Inchi： 1S/C17H27NO3/c1-13(2)8-6-4-3-5-7-11-21-17(20)15-12-14(19)9-10-16(15)18/h9-10,12-13,19H,3-8,11,18H2,1-2H3
- InChI Key： WQDDSULPVSBTBO-UHFFFAOYSA-N
- SMILES： O(C(C1C=C(C=CC=1N)O)=O)CCCCCCCC(C)C
Computed Properties
- Exact Mass: 293.19921
- Monoisotopic Mass: 293.199094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 10
- Complexity: 294
- 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
- Topological Polar Surface Area: 72.6
- XLogP3: 5.5
Experimental Properties
- Density: 1.059
- Boiling Point: 447.2°Cat760mmHg
- Flash Point: 224.2°C
- Refractive Index: 1.531
- PSA: 72.55
Benzoic acid,2-amino-5-hydroxy-, 8-methylnonyl ester Related Literature
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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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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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