Cas no 25819-91-4 (Imidazo[1,2-a]pyrimidin-5(3H)-one,2,6,7,8-tetrahydro-7,7-dimethyl-2-(1-methylethenyl)-, (+)- (9CI))
25819-91-4 structure
Product Name:Imidazo[1,2-a]pyrimidin-5(3H)-one,2,6,7,8-tetrahydro-7,7-dimethyl-2-(1-methylethenyl)-, (+)- (9CI)
CAS No:25819-91-4
MF:C11H17N3O
MW:207.272182226181
CID:274529
PubChem ID:442841
Update Time:2025-04-19
Imidazo[1,2-a]pyrimidin-5(3H)-one,2,6,7,8-tetrahydro-7,7-dimethyl-2-(1-methylethenyl)-, (+)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Imidazo[1,2-a]pyrimidin-5(3H)-one,2,6,7,8-tetrahydro-7,7-dimethyl-2-(1-methylethenyl)-, (+)- (9CI)
- 7,7-dimethyl-2-prop-1-en-2-yl-2,3,6,8-tetrahydroimidazo[1,2-a]pyrimidin-5-one
- AC1L9DHW
- 2-isopropenyl-7,7-dimethyl-2,3,6,8-tetrahydroimidazo[1,2-a]pyrimidin-5-one
- 25819-91-4
- Alchornine
- DTXSID50331972
- CHEBI:2552
- Q27105720
- C10567
-
- Inchi: 1S/C11H17N3O/c1-7(2)8-6-14-9(15)5-11(3,4)13-10(14)12-8/h8H,1,5-6H2,2-4H3,(H,12,13)
- InChI Key: OWOGBGTWYNGTCR-UHFFFAOYSA-N
- SMILES: CC(C1N=C2NC(CC(N2C1)=O)(C)C)=C
Computed Properties
- Exact Mass: 207.13731
- Monoisotopic Mass: 207.137
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 357
- 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: 0.8
- Topological Polar Surface Area: 44.7?2
Experimental Properties
- Density: 1.2
- Boiling Point: 287.5°Cat760mmHg
- Flash Point: 127.7°C
- Refractive Index: 1.599
- PSA: 44.7
Imidazo[1,2-a]pyrimidin-5(3H)-one,2,6,7,8-tetrahydro-7,7-dimethyl-2-(1-methylethenyl)-, (+)- (9CI) Related Literature
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N. K. Hart,S. R. Johns,J. A. Lamberton J. Chem. Soc. D 1969 1484
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2. Chapter 14. Alkaloids
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