Cas no 495-20-5 (conhydrine)
conhydrine structure
Product Name:conhydrine
CAS No:495-20-5
MF:C8H17NO
MW:143.226682424545
CID:331171
PubChem ID:11744748
Update Time:2025-04-19
conhydrine Chemical and Physical Properties
Names and Identifiers
-
- conhydrine
- pseudoconhydrine
- α-hydroxyconiine
- (2S,αR)-α-Ethyl-2-piperidinemethanol
- (αR,2S)-α-Ethylpiperidine-2α-methanol
- (1S)-1-[(2S)-2-Piperidinyl]-1-propanol
- (2S,αS)-α-Ethylpiperidine-2α-methanol
- (αS,2S)-α-Ethylpiperidine-2α-methanol
- (1R)-1-[(2S)-2-Piperidinyl]-1-propanol
- 2-Piperidinemethanol, a-ethyl-, (aR,2S)-
- (+-)-allantoin, compound with sulfanilamide
- (+-)-Allantoin, Verbindung mit Sulfanilamid
- (+)-conhydrine
- (1'R,2S)-2-[1'-(hydroxy)propyl]pireridine
- (2'S,1R)-1-(2-piperidyl)propan-1-ol
- 1-piperidin-2-ylpropan-1-ol
- SULFALLANTOIN
- sulfanilamide
- 2-Piperidinemethanol, alpha-ethyl-, (R-(R*,S*))-
- (+)-.ALPHA.-CONHYDRINE
- 495-20-5
- Conhydrin
- NS00042507
- DTXSID10879264
- EINECS 207-798-1
- Q21EOC14Q2
- (R-(R*,S*))-alpha-Ethyl-2-piperidinemethanol
- SCHEMBL3478050
- AKOS040750346
- Q409921
- (.ALPHA.R,2S)-.ALPHA.-ETHYL-2-PIPERIDINEMETHANOL
- BRN 0080052
- (1R)-1-[(2S)-Piperidin-2-yl]propan-1-ol
- 2-PIPERIDINEMETHANOL, .ALPHA.-ETHYL-, (.ALPHA.R,2S)-
- CONHYDRINE [MI]
- CONHYDRINE, (+)-
- UNII-Q21EOC14Q2
- alpha-Conhydrine
-
- Inchi： 1S/C8H17NO/c1-2-8(10)7-5-3-4-6-9-7/h7-10H,2-6H2,1H3/t7-,8+/m0/s1
- InChI Key： VCCAAURNBULZRR-JGVFFNPUSA-N
- SMILES： O[C@H](CC)[C@@H]1CCCCN1
Computed Properties
- Exact Mass: 143.131014166g/mol
- Monoisotopic Mass: 143.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 95.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- Density: 0.9636 (rough estimate)
- Melting Point: 121°
- Boiling Point: bp 226°
- Refractive Index: 1.4852 (estimate)
- Specific Rotation: D +10°
conhydrine Related Literature
-
Sharad Chandrakant Deshmukh,Arundhati Roy,Pinaki Talukdar Org. Biomol. Chem. 2012 10 7536
-
José A. Gálvez,María D. Díaz de Villegas,Ramón Badorrey,Pilar López-Ram-de-Víu Org. Biomol. Chem. 2011 9 8155
-
Subhash P. Chavan,Lalit B. Khairnar,Kailash P. Pawar,Prakash N. Chavan,Sanket A. Kawale RSC Adv. 2015 5 50580
-
Isabell Haym,Margaret A. Brimble Org. Biomol. Chem. 2012 10 7649
-
5. Recent advances in the Overman rearrangement: synthesis of natural products and valuable compoundsRodney A. Fernandes,Pullaiah Kattanguru,Sachin P. Gholap,Dipali A. Chaudhari Org. Biomol. Chem. 2017 15 2672
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