Cas no 61203-57-4 (Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester)
61203-57-4 structure
Product Name:Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester
CAS No:61203-57-4
MF:C10H13NO4
MW:211.214523077011
CID:488573
PubChem ID:71398291
Update Time:2025-04-19
Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester
- methyl 4-amino-2,3-dimethoxybenzoate
- DTXSID80819733
- 61203-57-4
-
- Inchi： 1S/C10H13NO4/c1-13-8-6(10(12)15-3)4-5-7(11)9(8)14-2/h4-5H,11H2,1-3H3
- InChI Key： APUYEGBIACZCOJ-UHFFFAOYSA-N
- SMILES： O(C)C1C(=C(C=CC=1C(=O)OC)N)OC
Computed Properties
- Exact Mass: 211.08449
- Monoisotopic Mass: 211.08445790g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 222
- 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: 1
- Topological Polar Surface Area: 70.8?2
Experimental Properties
- PSA: 70.78
Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester Related Literature
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1. 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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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
61203-57-4 (Benzoic acid, 4-amino-2,3-dimethoxy-, methyl ester) Related Products
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