Cas no 70097-41-5 (dopamine, [7-3h(n)])
dopamine, [7-3h(n)] structure
Product Name:dopamine, [7-3h(n)]
CAS No:70097-41-5
MF:C8H11NO2
MW:157.194660902023
CID:974616
PubChem ID:12207256
Update Time:2025-04-19
dopamine, [7-3h(n)] Chemical and Physical Properties
Names and Identifiers
-
- dopamine, [7-3h(n)]
- CHEMBL3247442
- 70097-41-5
-
- Inchi: 1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2/i3T2
- InChI Key: VYFYYTLLBUKUHU-WTJCDBBSSA-N
- SMILES: OC1=C(C=CC(=C1)C([3H])([3H])CN)O
Computed Properties
- Exact Mass: 157.095427092g/mol
- Monoisotopic Mass: 157.095427092g/mol
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 119
- 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: 66.5?2
dopamine, [7-3h(n)] Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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