Cas no 31488-75-2 (1H-Benzimidazole-1-ethanamine,N-ethyl-)
31488-75-2 structure
Product Name:1H-Benzimidazole-1-ethanamine,N-ethyl-
CAS No:31488-75-2
MF:C11H15N3
MW:189.256901979446
CID:299117
PubChem ID:43479099
Update Time:2025-04-19
1H-Benzimidazole-1-ethanamine,N-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-1-ethanamine,N-ethyl-
- Benzimidazole,1-[2-(ethylamino)ethyl]- (8CI)
- 2-(1H-Benzo[d]imidazol-1-yl)-N-ethylethanamine
- AKOS009513097
- 31488-75-2
- SCHEMBL24863183
-
- Inchi： 1S/C11H15N3/c1-2-12-7-8-14-9-13-10-5-3-4-6-11(10)14/h3-6,9,12H,2,7-8H2,1H3
- InChI Key： DPMIMDPCWORIMS-UHFFFAOYSA-N
- SMILES： N1(C=NC2C=CC=CC1=2)CCNCC
Computed Properties
- Exact Mass: 189.12675
- Monoisotopic Mass: 189.127
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 172
- 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: 29.8A^2
- XLogP3: 1.3
Experimental Properties
- PSA: 29.85
1H-Benzimidazole-1-ethanamine,N-ethyl- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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3. 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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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