Cas no 412283-55-7 (3-Pyrrolidinemethanol,alpha,alpha,1-trimethyl-(9CI))
412283-55-7 structure
Product Name:3-Pyrrolidinemethanol,alpha,alpha,1-trimethyl-(9CI)
CAS No:412283-55-7
MF:C8H17NO
MW:143.226682424545
CID:326413
PubChem ID:20763649
Update Time:2024-02-29
3-Pyrrolidinemethanol,alpha,alpha,1-trimethyl-(9CI) Chemical and Physical Properties
Names and Identifiers
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- 3-Pyrrolidinemethanol, a,a,1-trimethyl-
- 3-Pyrrolidinemethanol,alpha,alpha,1-trimethyl-(9CI)
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- Inchi： 1S/C8H17NO/c1-8(2,10)7-4-5-9(3)6-7/h7,10H,4-6H2,1-3H3
- InChI Key： PBSSDYYWQILZHQ-UHFFFAOYSA-N
- SMILES： CC(C1CCN(C)C1)(O)C
Computed Properties
- Exact Mass: 143.131014166g/mol
- Monoisotopic Mass: 143.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 122
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 23.5?2
3-Pyrrolidinemethanol,alpha,alpha,1-trimethyl-(9CI) Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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