Cas no 75410-03-6 (1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate)
75410-03-6 structure
Product Name:1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate
CAS No:75410-03-6
MF:C13H17NO4
MW:251.278383970261
CID:844959
PubChem ID:15710526
Update Time:2025-04-19
1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate Chemical and Physical Properties
Names and Identifiers
-
- 1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate
- AKOS025149700
- A849742
- 75410-03-6
- SCHEMBL844171
-
- Inchi： 1S/C13H17NO4/c1-5-18-13(16)10-7(2)6-9(14)11(8(10)3)12(15)17-4/h6H,5,14H2,1-4H3
- InChI Key： OFBXYQLWNDBECP-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C(C)=CC(=C(C(=O)OC)C=1C)N)=O
Computed Properties
- Exact Mass: 251.11575802g/mol
- Monoisotopic Mass: 251.11575802g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 318
- 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: 2.6
- Topological Polar Surface Area: 78.6?2
1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
75410-03-6 (1-ethyl 3-methyl 4-amino-2,6-dimethylisophthalate) Related Products
- 59434-19-4(4-Aminophthalide)
- 87-25-2(Ethyl anthranilate)
- 18583-89-6(Methyl 3-amino-2-methylbenzoate)
- 19258-73-2(Methyl 2-amino-4,5-dimethylbenzoate)
- 103259-06-9(2-Amino-6-(methoxycarbonyl)benzoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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