Cas no 269071-46-7 (Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester)
269071-46-7 structure
Product Name:Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester
CAS No:269071-46-7
MF:C10H14N2O2
MW:194.230362415314
CID:247933
PubChem ID:45089315
Update Time:2025-04-19
Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester
- Benzoic acid, 5-amino-2-(dimethylamino)-, methyl ester (9CI)
- 269071-46-7
- methyl 5-amino-2-(dimethylamino)benzoate
- AKOS005068354
- SCHEMBL6161036
-
- Inchi： 1S/C10H14N2O2/c1-12(2)9-5-4-7(11)6-8(9)10(13)14-3/h4-6H,11H2,1-3H3
- InChI Key： XEKRORJSPIKUHC-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=C(C=CC=1N(C)C)N)=O
Computed Properties
- Exact Mass: 194.10562
- Monoisotopic Mass: 194.106
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 206
- 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: 2.2
- Topological Polar Surface Area: 55.6A^2
Experimental Properties
- PSA: 55.56
Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
269071-46-7 (Benzoic acid,5-amino-2-(dimethylamino)-, methyl ester) Related Products
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